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Cannabinomimetic lipid from a marine cyanobacterium.EBI
J Nat Prod 74: 2313-7 (2011)
University Of California
Carbonic anhydrase inhibitors: inhibition of human and bovine isoenzymes by benzenesulphonamides, cyclitols and phenolic compounds.BDB
J Enzyme Inhib Med Chem 27: 845-8 (2012)
Ondokuz Mayis University
Development of a bivalent dopamine D2 receptor agonist.EBI
J Med Chem 54: 7911-9 (2011)
Friedrich-Alexander University
Novel N-linked aminopiperidine inhibitors of bacterial topoisomerase type II: broad-spectrum antibacterial agents with reduced hERG activity.EBI
J Med Chem 54: 7834-47 (2011)
Astrazeneca R&D Boston
1,7-Naphthyridine 1-oxides as novel potent and selective inhibitors of p38 mitogen activated protein kinase.EBI
J Med Chem 54: 7899-910 (2011)
RhôNe-Poulenc Rorer
Design and synthesis of biotinylated inositol 1,3,4,5-tetrakisphosphate targeting Grp1 pleckstrin homology domain.EBI
Bioorg Med Chem 19: 6833-41 (2011)
Kumamoto Health Science University
7-Oxopyrrolopyridine-derived DPP4 inhibitors-mitigation of CYP and hERG liabilities via introduction of polar functionalities in the active site.EBI
Bioorg Med Chem Lett 21: 6646-51 (2011)
Bristol-Myers Squibb Research And Development
Rational design of 2-pyrrolinones as inhibitors of HIV-1 integrase.EBI
Bioorg Med Chem Lett 21: 6724-7 (2011)
Fudan University
Molecular dynamics simulations and MM/GBSA methods to investigate binding mechanisms of aminomethylpyrimidine inhibitors with DPP-IV.EBI
Bioorg Med Chem Lett 21: 6630-5 (2011)
Graduate University Of The Chinese Academy Of Sciences
Synthesis and biological activity of new bispyridinium salts of 4,4'-bispyridyl-5,5'-perfluoroalkyl-2,2'-bisoxazoles.EBI
Eur J Med Chem 46: 5662-7 (2011)
Universidad Europea De Madrid
1-Aryl-5-(1H-pyrrol-1-yl)-1H-pyrazole-3-carboxamide: an effective scaffold for the design of either CB1 or CB2 receptor ligands.EBI
Eur J Med Chem 46: 5641-53 (2011)
Sapienza University Of Rome
Metabolism-directed design of oxetane-containing arylsulfonamide derivatives as ?-secretase inhibitors.EBI
J Med Chem 54: 7772-83 (2011)
Pfizer
Discovery of N-[2-hydroxy-6-(4-methoxybenzamido)phenyl]-4- (4-methyl-1,4-diazepan-1-yl)benzamide (darexaban, YM150) as a potent and orally available factor Xa inhibitor.EBI
J Med Chem 54: 8051-65 (2011)
Astellas Pharma
Daedalols A-C, fungal-derived BACE1 inhibitors.EBI
Bioorg Med Chem 19: 6581-6 (2011)
University Of Hawaii At Manoa
Novel analgesic/anti-inflammatory agents: diarylpyrrole acetic esters endowed with nitric oxide releasing properties.EBI
J Med Chem 54: 7759-71 (2011)
Sapienza University Of Rome
Selective aurora kinase inhibitors identified using a taxol-induced checkpoint sensitivity screen.BDB
ACS Chem Biol 7: 185-96 (2012)
Harvard Medical School
Low molecular weight phosphotyrosine protein phosphatases as emerging targets for the design of novel therapeutic agents.EBI
J Med Chem 55: 2-22 (2012)
University Of Messina
Highly potent, selective, and orally active phosphodiesterase 10A inhibitors.EBI
J Med Chem 54: 7621-38 (2011)
Pfizer
Carbazole-containing arylcarboxamides as BACE1 inhibitors.EBI
Bioorg Med Chem Lett 21: 6657-61 (2011)
Universit£
Identification and SAR of selective inducible nitric oxide synthase (iNOS) dimerization inhibitors.EBI
Bioorg Med Chem Lett 21: 6888-94 (2011)
Kalypsys
A modular approach to trim cellular targets in anticancer drug discovery.EBI
Bioorg Med Chem Lett 21: 6641-5 (2011)
Instituto Universitario De Bio-Org£Nica Antonio Gonz£Lez (Iubo-Ag)
Docking studies of benzylidene anabaseine interactions witha7 nicotinic acetylcholine receptor (nAChR) and acetylcholine binding proteins (AChBPs): application to the design of relateda7 selective ligands.EBI
Eur J Med Chem 46: 5625-35 (2011)
Targacept
Design and synthesis of conformationally constrained inhibitors of non-nucleoside reverse transcriptase.EBI
J Med Chem 54: 7920-33 (2011)
Merck
Rational design of phosphoinositide 3-kinasea inhibitors that exhibit selectivity over the phosphoinositide 3-kinaseß isoform.EBI
J Med Chem 54: 7815-33 (2011)
Genentech
Chromone containing sulfonamides as potent carbonic anhydrase inhibitors.BDB
J Enzyme Inhib Med Chem 27: 744-7 (2012)
Ondokuz Mayis University
Synthesis and biological evaluation of novel N, N'-disubstituted urea and thiourea derivatives as potential anti-melanoma agents.BDB
J Enzyme Inhib Med Chem 27: 708-14 (2012)
Nanjing University
Potential Agents for Treating Cystic Fibrosis: Cyclic Tetrapeptides that Restore Trafficking and Activity of ¿F508-CFTR.EBI
ACS Med Chem Lett 2: 703-707 (2011)
TBA
In vitro validation of acetyltransferase activity of GlmU as an antibacterial target in Haemophilus influenzae.BDB
J Biol Chem 286: 40734-42 (2011)
Astrazeneca
Synthesis of purine modified 2'-C-methyl nucleosides as potential anti-HCV agents.EBI
Bioorg Med Chem Lett 21: 6788-92 (2011)
Emory University
Discovery of 3-hydroxy-4-cyano-isoquinolines as novel, potent, and selective inhibitors of human 11ß-hydroxydehydrogenase 1 (11ß-HSD1).EBI
Bioorg Med Chem Lett 21: 6693-8 (2011)
Bristol-Myers Squibb Research & Development
Synthesis and structure-activity relationship studies of dihydronaphthyridinediones as a novel structural class of potent and selective PDE7 inhibitors.EBI
Bioorg Med Chem Lett 21: 6652-6 (2011)
Biocrea
Design, synthesis, and SAR studies of novel polycyclic acids as potent and selective inhibitors of human 11ß-hydroxysteroid dehydrogenase type 1 (11ß-HSD-1).EBI
Bioorg Med Chem Lett 21: 6699-704 (2011)
Bristol-Myers Squibb
Synthesis and acrosin inhibitory activity of substituted 4-amino-N-(diaminomethylene) benzenesulfonamide derivatives.EBI
Bioorg Med Chem Lett 21: 6674-7 (2011)
Second Military Medical University
9,10-secosteroids, protein kinase inhibitors from the Chinese gorgonian Astrogorgia sp.EBI
Bioorg Med Chem 19: 6873-80 (2011)
Peking University
Design, synthesis and biological evaluation of 6-pyridylmethylaminopurines as CDK inhibitors.EBI
Bioorg Med Chem 19: 6949-65 (2011)
The Institute Of Cancer Research
Discovery of new orally active prostaglandin D2 receptor antagonists.EBI
Bioorg Med Chem 19: 6935-48 (2011)
Ono Pharmaceutical
Identification of a novel RAMP-independent CGRP receptor antagonist.EBI
Bioorg Med Chem Lett 21: 6705-8 (2011)
Merck Research Laboratories
7-(4H-1,2,4-Triazol-3-yl)benzo[c][2,6]naphthyridines: a novel class of Pim kinase inhibitors with potent cell antiproliferative activity.EBI
Bioorg Med Chem Lett 21: 6687-92 (2011)
Cylene Pharmaceuticals
A novel potential therapeutic avenue for autism: design, synthesis and pharmacophore generation of SSRIs with dual action.EBI
Bioorg Med Chem Lett 21: 6714-23 (2011)
Qatar University
Discovery, synthesis and SAR analysis of novel selective small molecule S1P4-R agonists based on a (2Z,5Z)-5-((pyrrol-3-yl)methylene)-3-alkyl-2-(alkylimino)thiazolidin-4-one chemotype.EBI
Bioorg Med Chem Lett 21: 6739-45 (2011)
The Scripps Research Institute
Continued exploration of biphenylsulfonamide scaffold as a platform for aggrecanase-1 inhibition.EBI
Bioorg Med Chem Lett 21: 6800-3 (2011)
Pfizer
The design, synthesis and biological evaluation of novel URB602 analogues as potential monoacylglycerol lipase inhibitors.EBI
Bioorg Med Chem Lett 21: 6782-7 (2011)
Monash University (Parkville Campus)
Synthesis, biological assay in vitro and molecular docking studies of new Schiff base derivatives as potential urease inhibitors.EBI
Eur J Med Chem 46: 5473-9 (2011)
Comsats Institute Of Information Technology
Discovery of a potent, selective, and orally available class I phosphatidylinositol 3-kinase (PI3K)/mammalian target of rapamycin (mTOR) kinase inhibitor (GDC-0980) for the treatment of cancer.EBI
J Med Chem 54: 7579-87 (2011)
Genentech
Polyphenol fatty acid esters as serine protease inhibitors: a quantum-chemical QSAR analysis.BDB
J Enzyme Inhib Med Chem 27: 800-9 (2012)
Slovak University Of Technology
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents.EBI
Bioorg Med Chem 19: 6182-95 (2011)
University Of Hawaii At Hilo
Discovery of orteronel (TAK-700), a naphthylmethylimidazole derivative, as a highly selective 17,20-lyase inhibitor with potential utility in the treatment of prostate cancer.EBI
Bioorg Med Chem 19: 6383-99 (2011)
Takeda Pharmaceutical
Discovery and SAR exploration of a novel series of imidazo[4,5-b]pyrazin-2-ones as potent and selective mTOR kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 6793-9 (2011)
Celgene
Structural requirement of phenylthiourea analogs for their inhibitory activity of melanogenesis and tyrosinase.EBI
Bioorg Med Chem Lett 21: 6824-8 (2011)
Chungnam National University
4-N-Hydroxy-4-[1-(sulfonyl)piperidin-4-yl]-butyramides as HDAC inhibitors.EBI
Bioorg Med Chem Lett 21: 6767-9 (2011)
Menarini Ricerche Pomezia
Synthesis and radioligand binding studies of bis-(8-isopropyl-isoquinolinium) derivatives as ligands for apamin-sensitive sites on cloned SK2 and SK3 channels.EBI
Bioorg Med Chem Lett 21: 6756-9 (2011)
University Of Li£Ge
Discovery of highly potent small molecule Hepatitis C Virus entry inhibitors.EBI
Bioorg Med Chem Lett 21: 6852-5 (2011)
Itherx Pharmaceuticals
Synthesis and preliminary evaluation of amiloride analogs as inhibitors of the urokinase-type plasminogen activator (uPA).EBI
Bioorg Med Chem Lett 21: 6760-6 (2011)
University Of Wollongong
Superpotent [Dmt¹] dermorphin tetrapeptides containing the 4-aminotetrahydro-2-benzazepin-3-one scaffold with mixedµ/d opioid receptor agonistic properties.EBI
J Med Chem 54: 7848-59 (2011)
Vrije Universiteit Brussel
Melanin-concentrating hormone receptor 1 antagonists: synthesis, structure-activity relationship, docking studies, and biological evaluation of 2,3,4,5-tetrahydro-1H-3-benzazepine derivatives.EBI
Bioorg Med Chem 19: 6261-73 (2011)
Takeda Pharmaceutical
Binding of isoxazole and pyrazole derivatives of curcumin with the activator binding domain of novel protein kinase C.EBI
Bioorg Med Chem 19: 6196-202 (2011)
University Of Houston
Formulating a new basis for the treatment against botulinum neurotoxin intoxication: 3,4-Diaminopyridine prodrug design and characterization.EBI
Bioorg Med Chem 19: 6203-9 (2011)
The Scripps Research Institute
Synthesis and characterization of [¹²¿?¿I]2-iodo N-[(S)-{(S)-1-methylpiperidin-2-yl}(phenyl)methyl]3-trifluoromethyl-benzamide as novel imaging probe for glycine transporter 1.EBI
Bioorg Med Chem 19: 6245-53 (2011)
Nagasaki University
Identification of novel NK1/NK3 dual antagonists for the potential treatment of schizophrenia.EBI
Bioorg Med Chem Lett 21: 6899-904 (2011)
Glaxosmithkline
AHL-dependent quorum sensing inhibition: synthesis and biological evaluation ofa-(N-alkyl-carboxamide)-¿-butyrolactones anda-(N-alkyl-sulfonamide)-¿-butyrolactones.EBI
Bioorg Med Chem Lett 21: 6876-9 (2011)
Insa Lyon
Synthesis and in vivo evaluation of cyclic diaminopropane BACE-1 inhibitors.EBI
Bioorg Med Chem Lett 21: 6909-15 (2011)
Bristol-Myers Squibb Research And Development
A fluorescent probe for GM1 gangliosidosis relatedß-galactosidase: N-(dansylamino)hexylaminocarbonylpentyl-1,5-dideoxy-1,5-imino-D-galactitol.EBI
Bioorg Med Chem Lett 21: 6872-5 (2011)
Industrial Research
Discovery of a new class of glucosylceramide synthase inhibitors.EBI
Bioorg Med Chem Lett 21: 6773-7 (2011)
Exelixis
Introduction of an electron withdrawing group on the hydroxyphenylnaphthol scaffold improves the potency of 17ß-hydroxysteroid dehydrogenase type 2 (17ß-HSD2) inhibitors.EBI
J Med Chem 54: 7547-57 (2011)
Saarland University
Tricyclic series of heat shock protein 90 (Hsp90) inhibitors part I: discovery of tricyclic imidazo[4,5-c]pyridines as potent inhibitors of the Hsp90 molecular chaperone.EBI
J Med Chem 54: 7206-19 (2011)
Sanofi-Aventis Research And Development
Design, synthesis, and evaluation of a novel dual FMS-like tyrosine kinase 3/stem cell factor receptor (FLT3/c-KIT) inhibitor for the treatment of acute myelogenous leukemia.EBI
J Med Chem 54: 7184-92 (2011)
Vertex Pharmaceuticals
Mechanistic studies of substrate-assisted inhibition of ubiquitin-activating enzyme by adenosine sulfamate analogues.BDB
J Biol Chem 286: 40867-77 (2011)
Millennium Pharmaceuticals
Aminoacyl-tRNA synthetase inhibitors as potential antibiotics.EBI
Eur J Med Chem 46: 5227-36 (2011)
Katholieke Universiteit Leuven
Improvement in oral bioavailability of 2,4-diaminopyrimidine c-Met inhibitors by incorporation of a 3-amidobenzazepin-2-one group.EBI
Bioorg Med Chem 19: 6274-84 (2011)
Cephalon
Identification of a potent and selectives¿? receptor agonist potentiating NGF-induced neurite outgrowth in PC12 cells.EBI
Bioorg Med Chem 19: 6210-24 (2011)
University Of Pavia
Novel orally active antimalarial thiazoles.EBI
J Med Chem 54: 7713-9 (2011)
University Of Cape Town
Targeting zymogen activation to control the matriptase-prostasin proteolytic cascade.EBI
J Med Chem 54: 7567-78 (2011)
University Of Maryland
Discovery, synthesis, and structure-activity relationship development of a series of N-4-(2,5-dioxopyrrolidin-1-yl)phenylpicolinamides (VU0400195, ML182): characterization of a novel positive allosteric modulator of the metabotropic glutamate receptor 4 (mGlu(4)) with oral efficacy in an antiparkinEBI
J Med Chem 54: 7639-47 (2011)
Vanderbilt University Medical Center
In vitro inhibition of the bile salt export pump correlates with risk of cholestatic drug-induced liver injury in humans.EBI
Drug Metab Dispos 40: 130-8 (2011)
Astrazeneca
Non-steroidal dissociated glucocorticoid agonists: indoles as A-ring mimetics and function-regulating pharmacophores.EBI
Bioorg Med Chem Lett 21: 6842-51 (2011)
Boehringer Ingelheim Pharmaceuticals
Identification of 4-quinolone derivatives as inhibitors of reactive oxygen species production from human umbilical vein endothelial cells.EBI
Bioorg Med Chem Lett 21: 6861-6 (2011)
Astellas Pharma
Synthesis, preliminary biological evaluation and molecular modeling of some new heterocyclic inhibitors of TACE.EBI
Eur J Med Chem 46: 5549-55 (2011)
Sun Pharma Advanced Research
Oligopeptide cyclophilin inhibitors: a reassessment.EBI
Eur J Med Chem 46: 5556-61 (2011)
Max Planck Research Unit For Enzymology Of Protein Folding
Design, synthesis and biological evaluation of mannosyl triazoles as FimH antagonists.EBI
Bioorg Med Chem 19: 6454-73 (2011)
University Of Basel
Synthesis and in vivo evaluation of [18F]N-(2-benzofuranylmethyl)-N'-[4-(2-fluoroethoxy)benzyl]piperazine, a novels1 receptor PET imaging agent.EBI
Bioorg Med Chem Lett 21: 6820-3 (2011)
The University Of Sydney
Fatty acids as natural specific inhibitors of the proto-oncogenic protein Shp2.EBI
Bioorg Med Chem Lett 21: 6833-7 (2011)
Xiamen University
Computational techniques are valuable tools for the discovery of protein-protein interaction inhibitors: the 14-3-3s case.EBI
Bioorg Med Chem Lett 21: 6867-71 (2011)
University Of Siena
Characterization of a novel and selective CB1 antagonist as a radioligand for receptor occupancy studies.EBI
Bioorg Med Chem Lett 21: 6856-60 (2011)
Bristol-Myers Squibb
Synthesis, biological evaluation, and molecular docking studies of 1,3,4-oxadiazole derivatives possessing 1,4-benzodioxan moiety as potential anticancer agents.EBI
Bioorg Med Chem 19: 6518-24 (2011)
Nanjing University
Structure-activity studies of diazabicyclo[3.3.0]octane-substituted pyrazines and pyridines as potent ?4?2 nicotinic acetylcholine receptor ligands.EBI
J Med Chem 54: 7678-92 (2011)
Abbott Laboratories
Lactam-stabilized helical analogues of the analgesicµ-conotoxin KIIIA.EBI
J Med Chem 54: 7558-66 (2011)
Monash University
Bioassay-guided identification of an anti-inflammatory prenylated acylphloroglucinol from Melicope ptelefolia and molecular insights into its interaction with 5-lipoxygenase.EBI
Bioorg Med Chem 19: 6340-7 (2011)
Universiti Putra Malaysia
Design, synthesis and biological evaluation of benzo[1.3.2]dithiazolium ylide 1,1-dioxide derivatives as potential dual cyclooxygenase-2/5-lipoxygenase inhibitors.EBI
Bioorg Med Chem 19: 6316-28 (2011)
National Taiwan University
Imidazo[1,5-a]quinoxalines as irreversible BTK inhibitors for the treatment of rheumatoid arthritis.EBI
Bioorg Med Chem Lett 21: 6258-63 (2011)
Pfizer
Discovery of 1-arylcarbonyl-6,7-dimethoxyisoquinoline derivatives as glutamine fructose-6-phosphate amidotransferase (GFAT) inhibitors.EBI
Bioorg Med Chem Lett 21: 6264-9 (2011)
Hoffmann-La Roche
2-Oxo-N-aryl-1,2,3,4-tetrahydroquinoline-6-sulfonamides as activators of the tumor cell specific M2 isoform of pyruvate kinase.EBI
Bioorg Med Chem Lett 21: 6322-7 (2011)
National Human Genome Research Institute
Indolin-2-one p38a inhibitors III: bioisosteric amide replacement.EBI
Bioorg Med Chem Lett 21: 6253-7 (2011)
RhôNe-Poulenc Rorer
Discovery and optimization of a biphenylacetic acid series of prostaglandin D2 receptor DP2 antagonists with efficacy in a murine model of allergic rhinitis.EBI
Bioorg Med Chem Lett 21: 6608-12 (2011)
Amira Pharmaceuticals
Discovery of aminobenzyloxyarylamides as¿ opioid receptor selective antagonists: application to preclinical development of a¿ opioid receptor antagonist receptor occupancy tracer.EBI
J Med Chem 54: 8000-12 (2011)
Eli Lilly
Synthesis and biochemical evaluation ofd(2)-isoxazoline derivatives as DNA methyltransferase 1 inhibitors.EBI
J Med Chem 54: 7663-77 (2011)
Universit£
Discovery of a series of potent and selective human H4 antagonists using ligand efficiency and libraries to explore structure-activity relationship (SAR).EBI
Bioorg Med Chem Lett 21: 6591-5 (2011)
Pfizer
Investigation of the pyrazinones as PDE5 inhibitors: evaluation of regioisomeric projections into the solvent region.EBI
Bioorg Med Chem Lett 21: 6348-52 (2011)
Pfizer
Discovery of pyrazoles as novel FPR1 antagonists.EBI
Bioorg Med Chem Lett 21: 6456-60 (2011)
Astrazeneca
Three-dimensional quantitative structure-activity relationship analyses of substrates of the human proton-coupled amino acid transporter 1 (hPAT1).EBI
Bioorg Med Chem 19: 6409-18 (2011)
Martin-Luther-University Halle-Wittenberg
1,1-Diarylalkenes as anticancer agents: dual inhibitors of tubulin polymerization and phosphodiesterase 4.EBI
Bioorg Med Chem 19: 6356-74 (2011)
Celgene
Lysine demethylases inhibitors.EBI
J Med Chem 54: 8236-50 (2011)
Kyoto Prefectural University Of Medicine
Optimization of propafenone analogues as antimalarial leads.EBI
J Med Chem 54: 7477-85 (2011)
St. Jude Children'S Research Hospital
Molecular modeling: a search for a calpain inhibitor as a new treatment for cataractogenesis.EBI
J Med Chem 54: 7503-22 (2011)
University Of Canterbury
Discovery of 2-(4-methylfuran-2(5H)-ylidene)malononitrile and thieno[3,2-b]thiophene-2-carboxylic acid derivatives as G protein-coupled receptor 35 (GPR35) agonists.EBI
J Med Chem 54: 7385-96 (2011)
Corning
Triazine-based vanilloid 1 receptor open channel blockers: design, synthesis, evaluation, and SAR analysis.EBI
J Med Chem 54: 7441-52 (2011)
Institut De Qu£Mica Avan£Ada De Catalunya
Discovery of novel 3,5-disubstituted indole derivatives as potent inhibitors of Pim-1, Pim-2, and Pim-3 protein kinases.EBI
Bioorg Med Chem Lett 21: 6366-9 (2011)
Novartis Institutes Of Biomedical Research
Combining symmetry elements results in potent naphthyridinone (NTD) HIV-1 integrase inhibitors.EBI
Bioorg Med Chem Lett 21: 6461-4 (2011)
Glaxosmithkline Research & Development
Discovery of a new class of bicyclic substituted hydroxyphenylmethanones as 17ß-hydroxysteroid dehydrogenase type 2 (17ß-HSD2) inhibitors for the treatment of osteoporosis.EBI
Eur J Med Chem 47: 1-17 (2012)
Saarland University
Synthesis and biological evaluation of novel 2-arylamino-3-(arylsulfonyl)quinoxalines as PI3Ka inhibitors.EBI
Eur J Med Chem 46: 5540-8 (2011)
Zhejiang University
Design, structure-activity relationship, and highly efficient asymmetric synthesis of 3-phenyl-4-benzylaminopiperidine derivatives as novel neurokinin-1 receptor antagonists.EBI
Bioorg Med Chem 19: 6430-46 (2011)
Takeda Pharmaceutical
Identification of novel plasmin inhibitors possessing nitrile moiety as warhead.EBI
Bioorg Med Chem Lett 21: 6305-9 (2011)
Hiroshima International University
Tetrahydroquinolines as a novel series of nonsteroidal selective androgen receptor modulators: structural requirements for better physicochemical and biological properties.EBI
Bioorg Med Chem Lett 21: 6310-3 (2011)
Kaken Pharmaceutical
Synthesis and evaluation of pyridazinone-phenethylamine derivatives as selective and orally bioavailable histamine H3 receptor antagonists with robust wake-promoting activity.EBI
Bioorg Med Chem Lett 21: 6362-5 (2011)
Cephalon
Design, synthesis, and structure-activity relationships of spirolactones bearing 2-ureidobenzothiophene as acetyl-CoA carboxylases inhibitors.EBI
Bioorg Med Chem Lett 21: 6314-8 (2011)
Takeda Pharmaceutical
Mepyramine-JNJ7777120-hybrid compounds show high affinity to hH(1)R, but low affinity to hH(4)R.EBI
Bioorg Med Chem Lett 21: 6274-80 (2011)
University Of Regensburg
Substituted indole-1-acetic acids as potent and selective CRTh2 antagonists-discovery of AZD1981.EBI
Bioorg Med Chem Lett 21: 6288-92 (2011)
Astrazeneca R&D Charnwood
Steroidal C-21 mercapto derivatives as dissociated steroids: discovery of an inhaled dissociated steroid.EBI
Bioorg Med Chem Lett 21: 6343-7 (2011)
Merck Research Laboratories
Synthesis and biological evaluation of new 3-(6-hydroxyindol-2-yl)-5-(Phenyl) pyridine or pyrazine V-Shaped molecules as kinase inhibitors and cytotoxic agents.EBI
Eur J Med Chem 46: 5416-34 (2011)
Universit£
Unichiral 2-(2'-pyrrolidinyl)-1,4-benzodioxanes: the 2R,2'S diastereomer of the N-methyl-7-hydroxy analogue is a potenta4ß2- anda6ß2-nicotinic acetylcholine receptor partial agonist.EBI
J Med Chem 54: 7588-601 (2011)
Universit£
Discovery of 1-amino-5H-pyrido[4,3-b]indol-4-carboxamide inhibitors of Janus kinase 2 (JAK2) for the treatment of myeloproliferative disorders.EBI
J Med Chem 54: 7334-49 (2011)
Merck
A sucrose-derived scaffold for multimerization of bioactive peptides.EBI
Bioorg Med Chem 19: 6474-82 (2011)
The University Of Arizona
Aminomethyltetrazoles as potential inhibitors of the¿-aminobutyric acid transporters mGAT1-mGAT4: synthesis and biological evaluation.EBI
Bioorg Med Chem 19: 6492-504 (2011)
Ludwig-Maximilians-University Munich
Homo- and hetero-dimers of inactive organophosphorous group binding at dual sites of AChE.EBI
Bioorg Med Chem Lett 21: 6404-8 (2011)
Chinese Academy Of Agricultural Sciences
Design and synthesis of a library of chemokine antagonists.EBI
Bioorg Med Chem Lett 21: 6249-52 (2011)
Novartis Institutes Of Biomedical Research
Benzofurans from Styrax agrestis as acetylcholinesterase inhibitors: structure-activity relationships and molecular modeling studies.EBI
J Nat Prod 74: 2081-8 (2011)
Guangzhou University Of Chinese Medicine
Structure-based design of dipeptide derivatives for the human neutral endopeptidase.EBI
Bioorg Med Chem 19: 5935-47 (2011)
Kao
Potent and selective 2-naphthylsulfonamide substituted hydroxamic acid inhibitors of matrix metalloproteinase-13.EBI
Bioorg Med Chem Lett 21: 6440-5 (2011)
Novartis Institutes For Biomedical Research
Asymmetric synthesis and biological evaluation of N-cyclohexyl-4-[1-(2,4-dichlorophenyl)-1-(p-tolyl)methyl]piperazine-1-carboxamide as hCB1 receptor antagonists.EBI
Eur J Med Chem 46: 5310-6 (2011)
Shanghai Institute Of Materia Medica
Recent progress in synthesis and bioactivity studies of indolizines.EBI
Eur J Med Chem 46: 5237-57 (2011)
University Of Botswana
Discovery of 3-(2,6-dichloro-3,5-dimethoxy-phenyl)-1-{6-[4-(4-ethyl-piperazin-1-yl)-phenylamino]-pyrimidin-4-yl}-1-methyl-urea (NVP-BGJ398), a potent and selective inhibitor of the fibroblast growth factor receptor family of receptor tyrosine kinase.EBI
J Med Chem 54: 7066-83 (2011)
Novartis Institute For Biomedical Research
Synthesis and Toll-like receptor 4 (TLR4) activity of phosphatidylinositol dimannoside analogues.EBI
J Med Chem 54: 7268-79 (2011)
Industrial Research
Discovery of aryloxy tetramethylcyclobutanes as novel androgen receptor antagonists.EBI
J Med Chem 54: 7693-704 (2011)
Pfizer
Novel diarylpyridinones, diarylpyridazinones and diarylphthalazinones as potential HIV-1 nonnucleoside reverse transcriptase inhibitors (NNRTIs).EBI
Bioorg Med Chem 19: 5924-34 (2011)
University Of Antwerp
Pyrazolo[1,5-a]pyrimidines, triazolo[1,5-a]pyrimidines and their tricyclic derivatives as corticotropin-releasing factor 1 (CRF¿?) receptor antagonists.EBI
Bioorg Med Chem 19: 5955-66 (2011)
Minase Research Institute
Synthesis, pharmacophore modeling and in vitro activity of 10,11-dihydrodibenzo[b,f]oxepine-4-carboxamide derivatives as novel and potent antagonists of the prostaglandin EP4 receptor.EBI
Bioorg Med Chem Lett 21: 6336-40 (2011)
Rottapharm Madaus
Design, synthesis, and biological evaluation of benzodiazepine-based SUMO-specific protease 1 inhibitors.EBI
Bioorg Med Chem Lett 21: 6389-92 (2011)
Shanghai Jiao Tong University
Development of a highly selective, orally bioavailable and CNS penetrant M1 agonist derived from the MLPCN probe ML071.EBI
Bioorg Med Chem Lett 21: 6451-5 (2011)
Vanderbilt University Medical Center
Discovery of two clinical histamine H(3) receptor antagonists: trans-N-ethyl-3-fluoro-3-[3-fluoro-4-(pyrrolidinylmethyl)phenyl]cyclobutanecarboxamide (PF-03654746) and trans-3-fluoro-3-[3-fluoro-4-(pyrrolidin-1-ylmethyl)phenyl]-N-(2-methylpropyl)cyclobutanecarboxamide (PF-03654764).EBI
J Med Chem 54: 7602-20 (2011)
Pfizer
Design, synthesis, and biological studies of efficient multivalent melanotropin ligands: tools toward melanoma diagnosis and treatment.EBI
J Med Chem 54: 7375-84 (2011)
Universit£
Crucial Role of 3-Bromoethyl in Removing the Estrogenic Activity of 17ß-HSD1 Inhibitor 16ß-(m-Carbamoylbenzyl)estradiol.EBI
ACS Med Chem Lett 2: 678-681 (2011)
TBA
NO-SSRIs: Nitric Oxide Chimera Drugs Incorporating a Selective Serotonin Reuptake Inhibitor.EBI
ACS Med Chem Lett 2: 656-661 (2011)
TBA
Ligand discovery from a dopamine D3 receptor homology model and crystal structure.BDB
Nat Chem Biol 7: 769-78 (2011)
University Of California San Francisco
The discovery of long-acting saligeninß2 adrenergic receptor agonists incorporating a urea group.EBI
Bioorg Med Chem 19: 6026-32 (2011)
Glaxosmithkline
Synthesis and biological evaluation of new opioid agonist and neurokinin-1 antagonist bivalent ligands.EBI
Bioorg Med Chem 19: 6135-42 (2011)
University Of Arizona
Inhibition of steroid sulfatase with 4-substituted estrone and estradiol derivatives.EBI
Bioorg Med Chem 19: 5999-6005 (2011)
University Of Waterloo
Synthesis and antitumor activity of 1,2,4-triazoles having 1,4-benzodioxan fragment as a novel class of potent methionine aminopeptidase type II inhibitors.EBI
Bioorg Med Chem 19: 5948-54 (2011)
Nanjing University
Discovery of novel Cobactin-T based matrix metalloproteinase inhibitors via a ring closing metathesis strategy.EBI
Bioorg Med Chem Lett 21: 6485-90 (2011)
Johnson & Johnson Pharmaceutical Research & Development
Fragment based discovery of a novel and selective PI3 kinase inhibitor.EBI
Bioorg Med Chem Lett 21: 6586-90 (2011)
Pfizer
Structure-activity relationship and enzyme kinetic studies on 4-aryl-1H-1,2,3-triazoles as indoleamine 2,3-dioxygenase (IDO) inhibitors.EBI
Eur J Med Chem 46: 5680-7 (2011)
Fudan University
Selectivity of 3'-O-methylponkoranol for inhibition of N- and C-terminal maltase glucoamylase and sucrase isomaltase, potential therapeutics for digestive disorders or their sequelae.EBI
Bioorg Med Chem Lett 21: 6491-4 (2011)
Simon Fraser University
5-(2'-Pyridyl)-2-aminothiazoles: alkyl amino sulfonamides and sulfamides as potent NPY(5) antagonists.EBI
Bioorg Med Chem Lett 21: 6500-4 (2011)
Lundbeck Research Usa
Exploiting the lipoic acid structure in the search for novel multitarget ligands against Alzheimer's disease.EBI
Eur J Med Chem 46: 5435-42 (2011)
University Of Bologna
Design, synthesis and primary activity assay of tripeptidomimetics as histone deacetylase inhibitors with linear linker and branched cap group.EBI
Eur J Med Chem 46: 5387-97 (2011)
Shandong University
Selective cholinesterase inhibition by lanostane triterpenes from fruiting bodies of Ganoderma lucidum.EBI
Bioorg Med Chem Lett 21: 6603-7 (2011)
Chungnam National University
Aminothiazoles as¿-secretase modulators.EBI
Bioorg Med Chem Lett 21: 6554-8 (2011)
F. Hoffmann-La Roche
Conversion of systemically-distributed triazole-based stearoyl-CoA desaturase (SCD) uHTS hits into liver-targeted SCD inhibitors.EBI
Bioorg Med Chem Lett 21: 6505-9 (2011)
Merck Frosst Centre For Therapeutic Research
Discovery of spiropiperidine-based potent and selective Orexin-2 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 6409-13 (2011)
Takeda Pharmaceutical
Synthesis of three novel fluorine-18 labeled analogues of L-deprenyl for positron emission tomography (PET) studies of monoamine oxidase B (MAO-B).EBI
J Med Chem 54: 7023-9 (2011)
Karolinska Institutet
Novel substrate-based inhibitors of human glutamate carboxypeptidase II with enhanced lipophilicity.EBI
J Med Chem 54: 7535-46 (2011)
Academy Of Sciences Of The Czech Republic
A new phenylalanine derivative acts as an antagonist at the AMPA receptor GluA2 and introduces partial domain closure: synthesis, resolution, pharmacology, and crystal structure.EBI
J Med Chem 54: 7289-98 (2011)
University Of Copenhagen
Synthesis and study of a series of 3-arylcoumarins as potent and selective monoamine oxidase B inhibitors.EBI
J Med Chem 54: 7127-37 (2011)
University Of Santiago De Compostela
Discovery and optimization of 1-(4-(pyridin-2-yl)benzyl)imidazolidine-2,4-dione derivatives as a novel class of selective cannabinoid CB2 receptor agonists.EBI
J Med Chem 54: 7350-62 (2011)
Merck Research Laboratories
Discovery of N-(3-(1-methyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-6-yl) thiophene-2-carboximidamide as a selective inhibitor of human neuronal nitric oxide synthase (nNOS) for the treatment of pain.EBI
J Med Chem 54: 7408-16 (2011)
Neuraxon
HLE-inhibitory alkaloids with a polyketide skeleton from the marine-derived fungus Coniothyrium cereale.EBI
J Nat Prod 74: 2282-5 (2011)
University Of Bonn
Synthesis and biological evaluation of phenstatin metabolites.EBI
Bioorg Med Chem 19: 6042-54 (2011)
University Of Lille
Metronidazole acid acyl sulfonamide: a novel class of anticancer agents and potential EGFR tyrosine kinase inhibitors.EBI
Bioorg Med Chem 19: 6069-76 (2011)
Nanjing University
Lead identification ofß-lactam and related imine inhibitors of the molecular chaperone heat shock protein 90.EBI
Bioorg Med Chem 19: 6055-68 (2011)
Trinity College
Novel human mPGES-1 inhibitors identified through structure-based virtual screening.EBI
Bioorg Med Chem 19: 6077-86 (2011)
University Of Kentucky
Acetylcholine binding protein (AChBP) as template for hierarchical in silico screening procedures to identify structurally novel ligands for the nicotinic receptors.EBI
Bioorg Med Chem 19: 6107-19 (2011)
Vu University Amsterdam
Challenges of drug discovery in novel target space. The discovery and evaluation of PF-3893787: a novel histamine H4 receptor antagonist.EBI
Bioorg Med Chem Lett 21: 6596-602 (2011)
Pfizer
Inhibition of c-Kit, VEGFR-2 (KDR), and ABCG2 by analogues of OSI-930.EBI
Bioorg Med Chem Lett 21: 6495-9 (2011)
St. John'S University
New PDE4 inhibitors based on pharmacophoric similarity between papaverine and tofisopam.EBI
Bioorg Med Chem Lett 21: 6567-72 (2011)
University Of Strasburg
Tricyclic aminopyrimidine histamine H4 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 6577-81 (2011)
Johnson & Johnson Pharmaceutical Research & Development
Synthesis and in vitro evaluation of 7-methoxy-N-(pent-4-enyl)-1,2,3,4-tetrahydroacridin-9-amine-new tacrine derivate with cholinergic properties.EBI
Bioorg Med Chem Lett 21: 6563-6 (2011)
Charles University In Prague
Discovery and development ofa7 nicotinic acetylcholine receptor modulators.EBI
J Med Chem 54: 7943-61 (2011)
Targacept
Discovery of potent, selective, orally active benzoxazepine-based Orexin-2 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 6414-6 (2011)
Takeda Pharmaceutical
Design, synthesis and SAR of indazole and benzoisoxazole containing 4-azetidinyl-1-aryl-cyclohexanes as CCR2 antagonists.EBI
Bioorg Med Chem Lett 21: 6042-8 (2011)
Johnson & Johnson Pharmaceutical Research And Development
Discovery of potent, selective, and orally bioavailable alkynylphenoxyacetic acid CRTH2 (DP2) receptor antagonists for the treatment of allergic inflammatory diseases.EBI
J Med Chem 54: 7299-317 (2011)
Merck Serono
Design, synthesis, and X-ray crystallographic analysis of a novel class of HIV-1 protease inhibitors.EBI
J Med Chem 54: 7176-83 (2011)
Stevens Institute Of Technology
6-arylcoumarins as novel nonsteroidal type progesterone antagonists: an example with receptor-binding-dependent fluorescence.EBI
J Med Chem 54: 7055-65 (2011)
Ochanomizu University
Berkeleyones and related meroterpenes from a deep water acid mine waste fungus that inhibit the production of interleukin 1-ß from induced inflammasomes.EBI
J Nat Prod 74: 2273-7 (2011)
The University Of Montana
Discovery of novel selective norepinephrine inhibitors: 1-(2-morpholin-2-ylethyl)-3-aryl-1,3-dihydro-2,1,3-benzothiadiazole 2,2-dioxides (WYE-114152).EBI
J Med Chem 54: 6824-31 (2011)
Pfizer
Synthesis and structure-activity relationship studies in translocator protein ligands based on a pyrazolo[3,4-b]quinoline scaffold.EBI
J Med Chem 54: 7165-75 (2011)
Universit£
Thermodynamic evaluation of ligand binding in the plant-like phosphoethanolamine methyltransferases of the parasitic nematode Haemonchus contortus.BDB
J Biol Chem 286: 38060-8 (2011)
Washington University
Design, synthesis and biological evaluation of novel 1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid derivatives as aminopeptidase N/CD13 inhibitors.EBI
Bioorg Med Chem 19: 6015-25 (2011)
Shandong University
Potent inhibition of bacterial neuraminidase activity by pterocarpans isolated from the roots of Lespedeza bicolor.EBI
Bioorg Med Chem Lett 21: 6100-3 (2011)
Gyeongsang National University
Synthesis and biological evaluation of 1-substituted-3-(6-methylpyridin-2-yl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)pyrazoles as transforming growth factor-ß type 1 receptor kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 6049-53 (2011)
Ewha Womans University
Does the combination of optimal substitutions at the C²-, N¿?¿- and N¿?¿-positions of the pyrazolo-triazolo-pyrimidine scaffold guarantee selective modulation of the human A3 adenosine receptors?EBI
Bioorg Med Chem 19: 6120-34 (2011)
National University Of Singapore
Design and synthesis of potent, orally-active DGAT-1 inhibitors containing a dioxino[2,3-d]pyrimidine core.EBI
Bioorg Med Chem Lett 21: 6122-5 (2011)
Pfizer
CNS and antimalarial activity of synthetic meridianin and psammopemmin analogs.EBI
Bioorg Med Chem 19: 5756-62 (2011)
University Of South Florida
Effect of lipophilicity modulation on inhibition of human rhinovirus capsid binders.EBI
Bioorg Med Chem Lett 21: 6031-5 (2011)
Astrazeneca
Searching for new NO-donor aspirin-like molecules: Furoxanylacyl derivatives of salicylic acid and related furazans.EBI
Bioorg Med Chem 19: 5852-60 (2011)
Universit£
Novel thiophenyl C-aryl glucoside SGLT2 inhibitors as potential antidiabetic agents.EBI
Bioorg Med Chem 19: 5813-32 (2011)
Green Cross
Synthesis and structure-activity relationships of 4,5-fused pyridazinones as histamine H3 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 6126-30 (2011)
Cephalon
Design, synthesis, and biological evaluation of chromone-based p38 MAP kinase inhibitors.EBI
J Med Chem 54: 7427-31 (2011)
University Of Gothenburg
Design, synthesis, and functionalization of dimeric peptides targeting chemokine receptor CXCR4.EBI
J Med Chem 54: 7648-62 (2011)
Technische Universit£T M£Nchen
Deconstruction of thea4ß2 nicotinic acetylcholine receptor positive allosteric modulator desformylflustrabromine.EBI
J Med Chem 54: 7259-67 (2011)
Virginia Commonwealth University
Discovery of isoxazole analogues of sazetidine-A as selectivea4ß2-nicotinic acetylcholine receptor partial agonists for the treatment of depression.EBI
J Med Chem 54: 7280-8 (2011)
University Of Illinois At Chicago
Identification of novel small molecule inhibitors of 4-diphosphocytidyl-2-C-methyl-D-erythritol (CDP-ME) kinase of Gram-negative bacteria.EBI
Bioorg Med Chem 19: 5886-95 (2011)
University Of Utah
1-[2-(2-Benzoyl- and 2-benzylphenoxy)ethyl]uracils as potent anti-HIV-1 agents.EBI
Bioorg Med Chem 19: 5794-802 (2011)
Volgograd State Medical University
Inhibitory effect of novel 5-O-acyl juglones on mammalian DNA polymerase activity, cancer cell growth and inflammatory response.EBI
Bioorg Med Chem 19: 5803-12 (2011)
Kyoto Prefectural University
Exploiting differences in caspase-2 and -3 S2 subsites for selectivity: structure-based design, solid-phase synthesis and in vitro activity of novel substrate-based caspase-2 inhibitors.EBI
Bioorg Med Chem 19: 5833-51 (2011)
Chdi Management
Synthesis and structure-activity relationships of novel substituted 8-amino, 8-thio, and 1,8-pyrazole congeners of antitubercular rifamycin S and rifampin.EBI
Bioorg Med Chem Lett 21: 6094-9 (2011)
University Of Michigan
Discovery of GSK143, a highly potent, selective and orally efficacious spleen tyrosine kinase inhibitor.EBI
Bioorg Med Chem Lett 21: 6188-94 (2011)
Glaxosmithkline
Biological evaluation and docking studies of natural isocoumarins as inhibitors for human kallikrein 5 and 7.EBI
Bioorg Med Chem Lett 21: 6112-5 (2011)
Universidade Federal Do Tri£Ngulo Mineiro
Synthesis and biological activity of 2-(3'-hydroxypropylidene)-1a-hydroxy-19-norvitamin D analogues with shortened alkyl side chains.EBI
J Med Chem 54: 6832-42 (2011)
University Of Warsaw
Discovery of potent, orally bioavailable phthalazinone bradykinin B1 receptor antagonists.EBI
J Med Chem 54: 7232-46 (2011)
Amgen
Bioactive prenylogous cannabinoid from fiber hemp (Cannabis sativa).EBI
J Nat Prod 74: 2019-22 (2011)
Universita` Del Piemonte Orientale
Synthesis and pharmacological evaluation of indole-based sigma receptor ligands.EBI
Eur J Med Chem 46: 5154-61 (2011)
The University Of Mississippi
Monoamine oxidase inhibition by selected anilide derivatives.EBI
Eur J Med Chem 46: 5162-74 (2011)
North-West University
SAR and LC/MS studies ofß-lactamic inhibitors of human fatty acid amide hydrolase (hFAAH): evidence of a nonhydrolytic process.EBI
J Med Chem 54: 6812-23 (2011)
Universit£
P1-substituted symmetry-based human immunodeficiency virus protease inhibitors with potent antiviral activity against drug-resistant viruses.EBI
J Med Chem 54: 7094-104 (2011)
Abbott Laboratories
Azaxanthene based selective glucocorticoid receptor modulators: design, synthesis, and pharmacological evaluation of (S)-4-(5-(1-((1,3,4-thiadiazol-2-yl)amino)-2-methyl-1-oxopropan-2-yl)-5H-chromeno[2,3-b]pyridin-2-yl)-2-fluoro-N,N-dimethylbenzamide (BMS-776532) and its methylene homologue (BMS-791EBI
J Med Chem 54: 7318-33 (2011)
Bristol-Myers Squibb
Discovery of (+)-N-(3-aminopropyl)-N-[1-(5-benzyl-3-methyl-4-oxo-[1,2]thiazolo[5,4-d]pyrimidin-6-yl)-2-methylpropyl]-4-methylbenzamide (AZD4877), a kinesin spindle protein inhibitor and potential anticancer agent.EBI
J Med Chem 54: 6734-50 (2011)
Astrazeneca
Structure-based design of pseudopeptidic inhibitors for SIRT1 and SIRT2.EBI
J Med Chem 54: 6456-68 (2011)
University Of Eastern Finland
Isomeric acetoxy analogs of celecoxib and their evaluation as cyclooxygenase inhibitors.EBI
Bioorg Med Chem Lett 21: 6074-80 (2011)
University Of Alberta
Conformationally constrained farnesoid X receptor (FXR) agonists: alternative replacements of the stilbene.EBI
Bioorg Med Chem Lett 21: 6154-60 (2011)
Glaxosmithkline
Modeling the molecular basis fora4ß1 integrin antagonism.EBI
Bioorg Med Chem 19: 5903-11 (2011)
Ian Wark Laboratories
Synthesis, biological evaluation and molecular docking studies of 1,3,4-thiadiazole derivatives containing 1,4-benzodioxan as potential antitumor agents.EBI
Bioorg Med Chem Lett 21: 6116-21 (2011)
Nanjing University
Acylglycinamides as inhibitors of glycine transporter type 1.EBI
Bioorg Med Chem Lett 21: 6176-9 (2011)
Glaxosmithkline
The structural requirements of histone deacetylase inhibitors: Suberoylanilide hydroxamic acid analogs modified at the C3 position display isoform selectivity.EBI
Bioorg Med Chem Lett 21: 6139-42 (2011)
Wayne State University
Inhibition of xc¿?¿ transporter-mediated cystine uptake by sulfasalazine analogs.EBI
Bioorg Med Chem Lett 21: 6184-7 (2011)
Johns Hopkins University
Synthesis of novel triplet drugs with 1,3,5-trioxazatriquinane skeletons and their pharmacologies. Part 2: Synthesis of novel triplet drugs with the epoxymethano structure (capped homotriplet).EBI
Bioorg Med Chem Lett 21: 6198-202 (2011)
Kitasato University
Design, synthesis and X-ray crystallographic study of new nonsecosteroidal vitamin D receptor ligands.EBI
Bioorg Med Chem Lett 21: 6104-7 (2011)
National Institute Of Health Sciences
Discovery of potent, metabolically stable purine CRF-1 antagonists with differentiated binding kinetic profiles.EBI
Bioorg Med Chem Lett 21: 6108-11 (2011)
Pfizer
Discovery of gemfibrozil analogues that activate PPARa and enhance the expression of gene CPT1A involved in fatty acids catabolism.EBI
Eur J Med Chem 46: 5218-24 (2011)
Universit£
Design and synthesis of inhaled p38 inhibitors for the treatment of chronic obstructive pulmonary disease.EBI
J Med Chem 54: 7797-814 (2011)
Pfizer
Chiral indolo[3,2-f][3]benzazecine-type dopamine receptor antagonists: synthesis and activity of racemic and enantiopure derivatives.EBI
J Med Chem 54: 7422-6 (2011)
Martin-Luther-Universit£T Halle-Wittenberg
Design and synthesis of new prostaglandin D2 receptor antagonists.EBI
Bioorg Med Chem 19: 5361-71 (2011)
Minase Research Institute
Biochemical characterization of a novel type-II VEGFR2 kinase inhibitor: comparison of binding to non-phosphorylated and phosphorylated VEGFR2.EBI
Bioorg Med Chem 19: 5342-51 (2011)
Takeda Pharmaceutical
Sulfonamides as selective oestrogen receptorß agonists.EBI
Bioorg Med Chem Lett 21: 5680-3 (2011)
Pfizer
Discovery of a highly potent series of TLR7 agonists.EBI
Bioorg Med Chem Lett 21: 5939-43 (2011)
Pfizer
Design, synthesis and structure-activity relationship of novel [3.3.1] bicyclic sulfonamide-pyrazoles as potent ?-secretase inhibitors.EBI
Bioorg Med Chem Lett 21: 5791-4 (2011)
Elan Pharmaceuticals
Discovery of PF-184563, a potent and selective V1a antagonist for the treatment of dysmenorrhoea. The influence of compound flexibility on microsomal stability.EBI
Bioorg Med Chem Lett 21: 5684-7 (2011)
Pfizer
Novel indole and azaindole (pyrrolopyridine) cannabinoid (CB) receptor agonists: design, synthesis, structure-activity relationships, physicochemical properties and biological activity.EBI
Eur J Med Chem 46: 5086-98 (2011)
Abbott Healthcare Products
Synthesis and biological evaluation of novel analogues of the pan class I phosphatidylinositol 3-kinase (PI3K) inhibitor 2-(difluoromethyl)-1-[4,6-di(4-morpholinyl)-1,3,5-triazin-2-yl]-1H-benzimidazole (ZSTK474).EBI
J Med Chem 54: 7105-26 (2011)
University Of Auckland
The development of N-a-(2-carboxyl)benzoyl-N(5)-(2-fluoro-1-iminoethyl)-l-ornithine amide (o-F-amidine) and N-a-(2-carboxyl)benzoyl-N(5)-(2-chloro-1-iminoethyl)-l-ornithine amide (o-Cl-amidine) as second generation protein arginine deiminase (PAD) inhibitors.EBI
J Med Chem 54: 6919-35 (2011)
The Scripps Research Institute
Small molecule receptor protein tyrosine phosphatase¿ (RPTP¿) ligands that inhibit phosphatase activity via perturbation of the tryptophan-proline-aspartate (WPD) loop.EBI
J Med Chem 54: 6548-62 (2011)
Bristol-Myers Squibb Research And Development
2-thioxanthines are mechanism-based inactivators of myeloperoxidase that block oxidative stress during inflammation.BDB
J Biol Chem 286: 37578-89 (2011)
Astrazeneca R&D
Hydrolytic mechanism of OXA-58 enzyme, a carbapenem-hydrolyzing class D β-lactamase from Acinetobacter baumannii.BDB
J Biol Chem 286: 37292-303 (2011)
York University
Chemical modifications of resveratrol for improved protein kinase C alpha activity.EBI
Bioorg Med Chem 19: 5321-33 (2011)
University Of Houston
Synthesis and acrosin inhibitory activities of substituted ethyl 5-(4-aminophenyl)-1H-pyrazole-3-carboxylate derivatives.EBI
Bioorg Med Chem Lett 21: 5822-5 (2011)
Second Military Medical University
Design and synthesis of long acting inhaled corticosteroids for the treatment of asthma.EBI
Bioorg Med Chem Lett 21: 5826-30 (2011)
Pfizer
Conformationally constrained analogs of BAY 59-3074 as novel cannabinoid receptor ligands.EBI
Bioorg Med Chem Lett 21: 5999-6002 (2011)
Northeastern University
Discovery of inhibitors of plasminogen activator inhibitor-1: structure-activity study of 5-nitro-2-phenoxybenzoic acid derivatives.EBI
Bioorg Med Chem Lett 21: 5701-6 (2011)
Zydus Research Centre
Biophysical and physicochemical methods differentiate highly ligand-efficient human D-amino acid oxidase inhibitors.EBI
Eur J Med Chem 46: 4808-19 (2011)
Abbott Healthcare Products
Synthesis, biological, and antitumor activity of a highly potent 6-substituted pyrrolo[2,3-d]pyrimidine thienoyl antifolate inhibitor with proton-coupled folate transporter and folate receptor selectivity over the reduced folate carrier that inhibits b-glycinamide ribonucleotide formyltransferase.EBI
J Med Chem 54: 7150-64 (2011)
Duquesne University
Synthesis and pharmacological evaluation of 1-alkyl-N-[2-ethyl-2-(4-fluorophenyl)butyl]piperidine-4-carboxamide derivatives as novel antihypertensive agents.EBI
Bioorg Med Chem 19: 5628-38 (2011)
Astellas Pharma
Synthesis of a new trifluoromethylketone analogue of l-arginine and contrasting inhibitory activity against human arginase I and histone deacetylase 8.EBI
Bioorg Med Chem Lett 21: 5854-8 (2011)
Drexel University
Lead generation of heat shock protein 90 inhibitors by a combination of fragment-based approach, virtual screening, and structure-based drug design.EBI
Bioorg Med Chem Lett 21: 5778-83 (2011)
Chugai Pharmaceutical
Towards rational design of cannabinoid receptor 1 (CB1) antagonists for peripheral selectivity.EBI
Bioorg Med Chem Lett 21: 5711-4 (2011)
Rti International
2,5-Disubstituted-1,3,4-oxadiazoles/thiadiazole as surface recognition moiety: design and synthesis of novel hydroxamic acid based histone deacetylase inhibitors.EBI
Bioorg Med Chem Lett 21: 5735-8 (2011)
Guru Ghasidas University
Mitochondrial respiration inhibitors suppress protein translation and hypoxic signaling via the hyperphosphorylation and inactivation of translation initiation factor eIF2? and elongation factor eEF2.EBI
J Nat Prod 74: 1894-901 (2011)
University Of Mississippi
Quinoline antimalarials containing a dibemethin group are active against chloroquinone-resistant Plasmodium falciparum and inhibit chloroquine transport via the P. falciparum chloroquine-resistance transporter (PfCRT).EBI
J Med Chem 54: 6956-68 (2011)
University Of Cape Town
Effect of Inhibiting Histone Deacetylase with Short-Chain Carboxylic Acids and Their Hydroxamic Acid Analogs on Vertebrate Development and Neuronal Chromatin.EBI
ACS Med Chem Lett 2: 39-42 (2011)
Broad Institute Of Harvard And Mit
5a-Carba-ß-D-glucopyranose derivatives as novel sodium-dependent glucose cotransporter 2 (SGLT2) inhibitors for the treatment of type 2 diabetes.EBI
Bioorg Med Chem 19: 5334-41 (2011)
Chugai Pharmaceutical
SAR studies of acidic dual¿-secretase/PPAR¿ modulators.EBI
Bioorg Med Chem 19: 5372-82 (2011)
Goethe-University Frankfurt
Synthesis and structure-activity relationship of 4-quinolone-3-carboxylic acid based inhibitors of glycogen synthase kinase-3ß.EBI
Bioorg Med Chem Lett 21: 5948-51 (2011)
Activx Biosciences
Potent and novel 11ß-HSD1 inhibitors identified from shape and docking based virtual screening.EBI
Bioorg Med Chem Lett 21: 5739-44 (2011)
Shanghai Pharmaceutical Holding
Development of 2-substituted-N-(naphth-1-ylmethyl) and N-benzhydrylpyrimidin-4-amines as dual cholinesterase and Aß-aggregation inhibitors: Synthesis and biological evaluation.EBI
Bioorg Med Chem Lett 21: 5881-7 (2011)
University Of Waterloo
Improved synthesis and biological evaluation of chelator-modifieda-MSH analogs prepared by copper-free click chemistry.EBI
Bioorg Med Chem Lett 21: 5757-61 (2011)
The University Of Iowa
Discovery of BI 99179, a potent and selective inhibitor of type I fatty acid synthase with central exposure.EBI
Bioorg Med Chem Lett 21: 5924-7 (2011)
Boehringer Ingelheim Pharma
Identification of novel BRAF kinase inhibitors with structure-based virtual screening.EBI
Bioorg Med Chem Lett 21: 5753-6 (2011)
Sejong University
Arylazolylthioacetanilide. Part 8: Design, synthesis and biological evaluation of novel 2-(2-(2,4-dichlorophenyl)-2H-1,2,4-triazol-3-ylthio)-N-arylacetamides as potent HIV-1 inhibitors.EBI
Eur J Med Chem 46: 5039-45 (2011)
Shandong University
Fluorinated cannabinoid CB2 receptor ligands: synthesis and in vitro binding characteristics of 2-oxoquinoline derivatives.EBI
Bioorg Med Chem 19: 5698-707 (2011)
The University Of Texas
Discovery of a new class of HMG-CoA reductase inhibitor from Polyalthia longifolia as potential lipid lowering agent.EBI
Eur J Med Chem 46: 5206-11 (2011)
Central Drug Research Institute (Csir)
Synthesis and selective human monoamine oxidase inhibition of 3-carbonyl, 3-acyl, and 3-carboxyhydrazido coumarin derivatives.EBI
Eur J Med Chem 46: 4846-52 (2011)
Sapienza University Of Rome
Bicyclic heteroaryl inhibitors of stearoyl-CoA desaturase: from systemic to liver-targeting inhibitors.EBI
Bioorg Med Chem Lett 21: 5692-6 (2011)
Merck Frosst Centre For Therapeutic Research
Effects of linker elongation in a series of N-(2-benzofuranylmethyl)-N'-(methoxyphenylalkyl)piperazines¿? receptor ligands.EBI
Bioorg Med Chem Lett 21: 5707-10 (2011)
The University Of Sydney
Synthesis and biological activity of pyrido[3',2':4,5]furo[3,2-d]pyrimidine derivatives as novel and potent phosphodiesterase type 4 inhibitors.EBI
Eur J Med Chem 46: 4946-56 (2011)
RhôNe-Poulenc Rorer
Hybrids of oxoisoaporphine-tacrine congeners: novel acetylcholinesterase and acetylcholinesterase-inducedß-amyloid aggregation inhibitors.EBI
Eur J Med Chem 46: 4970-9 (2011)
Guangxi Normal University
Inhalation by design: novel tertiary amine muscarinic M3 receptor antagonists with slow off-rate binding kinetics for inhaled once-daily treatment of chronic obstructive pulmonary disease.EBI
J Med Chem 54: 6888-904 (2011)
Pfizer
Synthesis and characterization of high-affinity 4,4-difluoro-4-bora-3a,4a-diaza-s-indacene-labeled fluorescent ligands for humanß-adrenoceptors.EBI
J Med Chem 54: 6874-87 (2011)
University Of Nottingham
Synthesis, biological evaluation, and automated docking of constrained analogues of the opioid peptide H-Dmt-D-Ala-Phe-Gly-NH2 using the 4- or 5-methyl substituted 4-amino-1,2,4,5-tetrahydro-2-benzazepin-3-one scaffold.EBI
J Med Chem 54: 6538-47 (2011)
Vrije Universiteit Brussel
Actinopolysporins A-C and tubercidin as a Pdcd4 stabilizer from the halophilic actinomycete Actinopolyspora erythraea YIM 90600.EBI
J Nat Prod 74: 1990-5 (2011)
Yunnan University
Unprecedented selectivity and structural determinants of a new class of protein kinase CK2 inhibitors in clinical trials for the treatment of cancer.BDB
Biochemistry 50: 8478-88 (2011)
Venetian Institute Of Molecular Medicine
Substrate specificity of Sphingobium chlorophenolicum 2,6-dichlorohydroquinone 1,2-dioxygenase.BDB
Biochemistry 50: 8899-913 (2011)
Whitman College
Novel macrocyclic C-aryl glucoside SGLT2 inhibitors as potential antidiabetic agents.EBI
Bioorg Med Chem 19: 5468-79 (2011)
Green Cross
Exploration of pyridine containing heteroaryl analogs of biaryl ureas as DGAT1 inhibitors.EBI
Bioorg Med Chem Lett 21: 5812-7 (2011)
Piramal Life Sciences
Pyrazol-3-propanoic acid derivatives as novel inhibitors of leukotriene biosynthesis in human neutrophils.EBI
Eur J Med Chem 46: 5021-33 (2011)
Gazi University
Mechanisms of Osteoclastogenesis Inhibition by a Novel Class of Biphenyl-Type Cannabinoid CB(2) Receptor Inverse Agonists.BDB
Chem Biol 18: 1053-64 (2011)
University Of Bern
Targeting MgrA-Mediated Virulence Regulation in Staphylococcus aureus.BDB
Chem Biol 18: 1032-41 (2011)
The University Of Chicago
Selective water-soluble gelatinase inhibitor prodrugs.EBI
J Med Chem 54: 6676-90 (2011)
University Of Notre Dame
N'-(arylsulfonyl)pyrazoline-1-carboxamidines as novel, neutral 5-hydroxytryptamine 6 receptor (5-HT6R) antagonists with unique structural features.EBI
J Med Chem 54: 7030-54 (2011)
Abbott Healthcare Products
Structural determinants of opioid and NOP receptor activity in derivatives of buprenorphine.EBI
J Med Chem 54: 6531-7 (2011)
University Of Bath
2-({6-[(3R)-3-amino-3-methylpiperidine-1-yl]-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-5H-pyrrolo[3,2-d]pyrimidine-5-yl}methyl)-4-fluorobenzonitrile (DSR-12727): a potent, orally active dipeptidyl peptidase IV inhibitor without mechanism-based inactivation of CYP3A.EBI
Bioorg Med Chem 19: 5490-9 (2011)
Dainippon Sumitomo Pharma
6,7-Dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidines and their derivatives as novel corticotropin-releasing factor 1 receptor antagonists.EBI
Bioorg Med Chem 19: 5432-45 (2011)
Minase Research Institute
Derivatives of pyrrolo[3,4-d]pyridazinone, a new class of analgesic agents.EBI
Eur J Med Chem 46: 4992-9 (2011)
Wroclaw Medical University
4-benzimidazolyl-3-phenylbutanoic acids as novel PIF-pocket-targeting allosteric inhibitors of protein kinase PKC¿.EBI
J Med Chem 54: 6714-23 (2011)
Saarland University
Efficient conversion of a nonselective norepinephrin reuptake inhibitor into a dual muscarinic antagonist-ß2-agonist for the treatment of chronic obstructive pulmonary disease.EBI
J Med Chem 54: 6998-7002 (2011)
Pfizer
Cyclopentane-1,3-dione: a novel isostere for the carboxylic acid functional group. Application to the design of potent thromboxane (A2) receptor antagonists.EBI
J Med Chem 54: 6969-83 (2011)
University Of Pennsylvania
Assessment of dopamine D¿? receptor affinity and efficacy of three tetracyclic conformationally-restricted analogs of SKF38393.EBI
Bioorg Med Chem 19: 5420-31 (2011)
Purdue University
Synthesis and glycosidase inhibitory profiles of functionalised morpholines and oxazepanes.EBI
Bioorg Med Chem 19: 5679-92 (2011)
University Of Reading
N-(1,3-Diaryl-3-oxopropyl)amides as a new template for xanthine oxidase inhibitors.EBI
Bioorg Med Chem 19: 5569-76 (2011)
Indo-Soviet Friendship College Of Pharmacy
Identification and SAR of a new series of thieno[3,2-d]pyrimidines as Tpl2 kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 5952-6 (2011)
Pfizer
Novel inhibitors of NRH:quinone oxidoreductase 2 (NQO2): crystal structures, biochemical activity, and intracellular effects of imidazoacridin-6-ones.EBI
J Med Chem 54: 6597-611 (2011)
University Of Manchester
Optimization of (arylpiperazinylbutyl)oxindoles exhibiting selective 5-HT7 receptor antagonist activity.EBI
J Med Chem 54: 6657-69 (2011)
Egis Pharmaceuticals
2,7-disubstituted-pyrrolo[2,1-f][1,2,4]triazines: new variant of an old template and application to the discovery of anaplastic lymphoma kinase (ALK) inhibitors with in vivo antitumor activity.EBI
J Med Chem 54: 6328-41 (2011)
Cephalon
Combination of two pharmacophoric systems: synthesis and pharmacological evaluation of spirocyclic pyranopyrazoles with highs1 receptor affinity.EBI
J Med Chem 54: 6704-13 (2011)
Institut F£R Pharmazeutische Und Medizinische Chemie Der Universit£T M£Nster
Truncated (N)-Methanocarba Nucleosides as A(1) Adenosine Receptor Agonists and Partial Agonists: Overcoming Lack of a Recognition Element.EBI
ACS Med Chem Lett 2: 626-631 (2011)
TBA
Discovery, synthesis, and structure-activity relationship of 6-aminomethyl-7,8-dihydronaphthalenes as human melanin-concentrating hormone receptor 1 antagonists.EBI
Bioorg Med Chem 19: 5539-52 (2011)
Takeda Pharmaceutical
De novo design, synthesis and biological evaluation of 1,4-dihydroquinolin-4-ones and 1,2,3,4-tetrahydroquinazolin-4-ones as potent kinesin spindle protein (KSP) inhibitors.EBI
Bioorg Med Chem 19: 5612-27 (2011)
China Pharmaceutical University
Identification of potent c-Src inhibitors strongly affecting the proliferation of human neuroblastoma cells.EBI
Bioorg Med Chem Lett 21: 5928-33 (2011)
University Of Siena
Overcoming human P-glycoprotein-dependent multidrug resistance with novel dihydro-ß-agarofuran sesquiterpenes.EBI
Eur J Med Chem 46: 4915-23 (2011)
Instituto Universitario De Bio-Org£Nica Antonio Gonz£Lez (Iubo-Ag)
Inhibition of LuxS by S-ribosylhomocysteine analogues containing a [4-aza]ribose ring.EBI
Bioorg Med Chem 19: 5507-19 (2011)
Florida International University
Development and characterization of improvedß-lactone-based anti-virulence drugs targeting ClpP.EBI
Bioorg Med Chem 20: 583-91 (2012)
Technische Universit£T M£Nchen
Synthesis and characterization of tritylthioethanamine derivatives with potent KSP inhibitory activity.EBI
Bioorg Med Chem 19: 5446-53 (2011)
New Mexico State University
Substituted lactam and cyclic azahemiacetals modulate Pseudomonas aeruginosa quorum sensing.EBI
Bioorg Med Chem 19: 5500-6 (2011)
Florida International University
Discovery of potent and novel S-nitrosoglutathione reductase inhibitors devoid of cytochrome P450 activities.EBI
Bioorg Med Chem Lett 21: 5849-53 (2011)
N30 Pharmaceuticals
Design and evaluation of a novel fluorescent CB2 ligand as probe for receptor visualization in immune cells.EBI
Bioorg Med Chem Lett 21: 5859-62 (2011)
University Of Montana
Discovery of novel imidazo[1,2-a]pyrazin-8-amines as Brk/PTK6 inhibitors.EBI
Bioorg Med Chem Lett 21: 5870-5 (2011)
Merck Research Laboratories
Ursolic acid is a PPAR-a agonist that regulates hepatic lipid metabolism.EBI
Bioorg Med Chem Lett 21: 5876-80 (2011)
Korea University
Identification of a potent and selective free fatty acid receptor 1 (FFA1/GPR40) agonist with favorable physicochemical and in vitro ADME properties.EBI
J Med Chem 54: 6691-703 (2011)
University Of Southern Denmark
Phenylethynylbenzenesulfonamide regioisomers strongly and selectively inhibit the transmembrane, tumor-associated carbonic anhydrase isoforms IX and XII over the cytosolic isoforms I and II.EBI
Bioorg Med Chem Lett 21: 5892-6 (2011)
University Of Alberta
Discovery and characterization of potent and selective 4-oxo-4-(5-(5-phenyl-1,2,4-oxadiazol-3-yl)indolin-1-yl)butanoic acids as S1P¿? agonists.EBI
Bioorg Med Chem Lett 21: 6013-8 (2011)
Arena Pharmaceuticals
Identification of 5,6-substituted 4-aminothieno[2,3-d]pyrimidines as LIMK1 inhibitors.EBI
Bioorg Med Chem Lett 21: 5992-4 (2011)
The Walter And Eliza Hall Institute Of Medical Research
RGD mimetics containing phthalimidine fragment as novel ligands of fibrinogen receptor.EBI
Bioorg Med Chem Lett 21: 5971-4 (2011)
A.V. Bogatsky Physico-Chemical Institute Of The National Academy Of Sciences Of Ukraine
Effects of some drugs on human cord blood erythrocyte carbonic anhydrases I and II: an in vitro study.BDB
J Enzyme Inhib Med Chem 27: 641-5 (2012)
Erzincan University
Targeting hypoxic tumor cell viability with carbohydrate-based carbonic anhydrase IX and XII inhibitors.EBI
J Med Chem 54: 6905-18 (2011)
Griffith University
Dihydroquinazolines as a novel class of Trypanosoma brucei trypanothione reductase inhibitors: discovery, synthesis, and characterization of their binding mode by protein crystallography.EBI
J Med Chem 54: 6514-30 (2011)
University Of Dundee
Virtual screening targeting the urokinase receptor, biochemical and cell-based studies, synthesis, pharmacokinetic characterization, and effect on breast tumor metastasis.EBI
J Med Chem 54: 7193-205 (2011)
Indiana University School Of Medicine
3,5-dimethylisoxazoles act as acetyl-lysine-mimetic bromodomain ligands.EBI
J Med Chem 54: 6761-70 (2011)
University Of Oxford
Discovery and kinetic evaluation of 6-substituted 4-benzylthio-1,3,5-triazin-2(1H)-ones as inhibitors of cathepsin B.EBI
Eur J Med Chem 46: 4648-56 (2011)
University Of Ljubljana
Synthesis and in vitro Evaluation of Novel Indole-Based Sigma Receptors Ligands.BDB
Chem Biol Drug Des 78: 869-75 (2011)
Yeditepe University
Synthesis and characterization of novel dioxoacridine sulfonamide derivatives as new carbonic anhydrase inhibitors.BDB
J Enzyme Inhib Med Chem 27: 509-14 (2012)
Dumlupinar University
Inhibitors of androgen receptor activation function-2 (AF2) site identified through virtual screening.EBI
J Med Chem 54: 6197-205 (2011)
University Of British Columbia
Anti-inflammatory endiandric acid analogues from the roots of Beilschmiedia tsangii.EBI
J Nat Prod 74: 1875-80 (2011)
Kaohsiung Medical University
A novel amino-benzosuberone derivative is a picomolar inhibitor of mammalian aminopeptidase N/CD13.EBI
Bioorg Med Chem 19: 5716-33 (2011)
Universit£
Pyrrolidin-3-yl-N-methylbenzamides as potent histamine 3 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 5957-60 (2011)
Pfizer
Synthesis and biological evaluation of 4-piperidinecarboxylate and 4-piperidinecyanide derivatives for T-type calcium channel blockers.EBI
Bioorg Med Chem Lett 21: 5910-5 (2011)
Korea Institute Of Science And Technology
3D QSAR and docking study of flavone derivatives as potent inhibitors of influenza H1N1 virus neuraminidase.EBI
Bioorg Med Chem Lett 21: 5964-70 (2011)
Chinese Academy Of Medical Sciences
Inhibition of COX-1 activity and COX-2 expression by 3-(4'-geranyloxy-3'-methoxyphenyl)-2-trans propenoic acid and its semi-synthetic derivatives.EBI
Bioorg Med Chem Lett 21: 5995-8 (2011)
Universit£
Agonists for the Chemokine Receptor CXCR4.EBI
ACS Med Chem Lett 2: 597-602 (2011)
TBA
Mechanistic analysis of trehalose synthase from Mycobacterium smegmatis.BDB
J Biol Chem 286: 35601-9 (2011)
University Of British Columbia
The structure-activity relationship of urea derivatives as anti-tuberculosis agents.EBI
Bioorg Med Chem 19: 5585-95 (2011)
St. Jude Children'S Research Hospital
Cracking the molecular weight barrier: fragment screening of an aminotransferase using an NMR-based functional assay.EBI
Bioorg Med Chem Lett 21: 5248-50 (2011)
Abbott Laboratories
Synthesis of various 3-nitropropionamides as Mycobacterium tuberculosis isocitrate lyase inhibitor.EBI
Bioorg Med Chem Lett 21: 5149-54 (2011)
Institute Of Technology And Science-Pilani
Structure-based optimization of potent 4- and 6-azaindole-3-carboxamides as renin inhibitors.EBI
Bioorg Med Chem Lett 21: 5480-6 (2011)
Deutschland
Discovery of amide replacements that improve activity and metabolic stability of a bis-amide smoothened antagonist hit.EBI
Bioorg Med Chem Lett 21: 5206-9 (2011)
Amgen
Structure-based design and optimization of potent renin inhibitors on 5- or 7-azaindole-scaffolds.EBI
Bioorg Med Chem Lett 21: 5487-92 (2011)
Sanofi-Aventis Deutschland
DNA site-specific N3-adenine methylation targeted to estrogen receptor-positive cells.EBI
Bioorg Med Chem 19: 5093-102 (2011)
University Of North Carolina At Wilmington
Synthesis and biological evaluation of 3-(1H-imidazol- and triazol-1-yl)-2,2-dimethyl-3-[4-(naphthalen-2-ylamino)phenyl]propyl derivatives as small molecule inhibitors of retinoic acid 4-hydroxylase (CYP26).EBI
J Med Chem 54: 6803-11 (2011)
Cardiff University
Discovery of a brain-penetrant S1P3-sparing direct agonist of the S1P¿? and S1P5 receptors efficacious at low oral dose.EBI
J Med Chem 54: 6724-33 (2011)
Glaxosmithkline
The discovery of benzanilides as c-Met receptor tyrosine kinase inhibitors by a directed screening approach.EBI
Bioorg Med Chem Lett 21: 5224-9 (2011)
Astrazeneca
New pyrazolyl and thienyl aminohydantoins as potent BACE1 inhibitors: exploring the S2' region.EBI
Bioorg Med Chem Lett 21: 5164-70 (2011)
Pfizer
Homology modeling in tandem with 3D-QSAR analyses: a computational approach to depict the agonist binding site of the human CB2 receptor.EBI
Eur J Med Chem 46: 4489-505 (2011)
Universit£
Discovery process and pharmacological characterization of a novel dual orexin 1 and orexin 2 receptor antagonist useful for treatment of sleep disorders.EBI
Bioorg Med Chem Lett 21: 5562-7 (2011)
Glaxosmithkline
Sulfonamides as a new scaffold for hypoxia inducible factor pathway inhibitors.EBI
Bioorg Med Chem Lett 21: 5528-32 (2011)
Emory University School Of Medicine
Structure-based design of new DHFR-based antibacterial agents: 7-aryl-2,4-diaminoquinazolines.EBI
Bioorg Med Chem Lett 21: 5171-6 (2011)
Trius Therapeutics, San Diego, Ca 92121, United States.
Pantolactams as androgen receptor antagonists for the topical suppression of sebum production.EBI
Bioorg Med Chem Lett 21: 5230-3 (2011)
Pfizer
Synthesis and evaluation of quinazolin-4-ones as hypoxia-inducible factor-1a inhibitors.EBI
Bioorg Med Chem Lett 21: 5239-43 (2011)
National Human Genome Research Institute
Definition of peptide inhibitors from a synthetic peptide library by targeting gelatinase B/matrix metalloproteinase-9 (MMP-9) and TNF-a converting enzyme (TACE/ADAM-17).BDB
J Enzyme Inhib Med Chem 27: 533-40 (2012)
China Pharmaceutical University
Sesterterpenes from the tropical sponge Coscinoderma sp.EBI
J Nat Prod 74: 1805-11 (2011)
Seoul National University
Discovery of a novel series of selective HCN1 blockers.EBI
Bioorg Med Chem Lett 21: 5197-201 (2011)
Johnson & Johnson Pharmaceutical Research & Development
Design and synthesis of novel amide AKT1 inhibitors with selectivity over CDK2.EBI
Bioorg Med Chem Lett 21: 5191-6 (2011)
Amgen
Characteristic of alkylated chalcones from Angelica keiskei on influenza virus neuraminidase inhibition.EBI
Bioorg Med Chem Lett 21: 5602-4 (2011)
Korea Research Institute Of Bioscience And Biotechnology
Amine-constrained pyridazinone histamine H3 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 5543-6 (2011)
Cephalon
Substitution of the phosphonic acid and hydroxamic acid functionalities of the DXR inhibitor FR900098: an attempt to improve the activity against Mycobacterium tuberculosis.EBI
Bioorg Med Chem Lett 21: 5403-7 (2011)
Uppsala University
Synthesis and biological activity of a novel class nicotinic acetylcholine receptors (nAChRs) ligands structurally related to anatoxin-a.EBI
Bioorg Med Chem Lett 21: 5423-7 (2011)
University Of Ferrara
1,6-Disubstituted indole derivatives as selective human neuronal nitric oxide synthase inhibitors.EBI
Bioorg Med Chem Lett 21: 5234-8 (2011)
Neuraxon
Tertiary amides with a five-membered heteroaromatic ring as new probes for the translocator protein.EBI
Eur J Med Chem 46: 4506-20 (2011)
Universit£
9-substituted 6,6-dimethyl-11-oxo-6,11-dihydro-5H-benzo[b]carbazoles as highly selective and potent anaplastic lymphoma kinase inhibitors.EBI
J Med Chem 54: 6286-94 (2011)
Chugai Pharmaceutical
Identification and characterization of a novel integrin-linked kinase inhibitor.EBI
J Med Chem 54: 6364-74 (2011)
The Ohio State University
Design and synthesis of novel arylpiperazine derivatives containing the imidazole core targeting 5-HT(2A) receptor and 5-HT transporter.EBI
J Med Chem 54: 6305-18 (2011)
Green Cross
Halogen-substituted (C-ß-D-glucopyranosyl)-hydroquinone regioisomers: synthesis, enzymatic evaluation and their binding to glycogen phosphorylase.EBI
Bioorg Med Chem 19: 5125-36 (2011)
National Hellenic Research Foundation
Synthesis and in vivo evaluation of [O-methyl-11C] N-[3,5-dichloro-2-(methoxy)phenyl]-4-(methoxy)-3-(1-piperazinyl)benzenesulfonamide as an imaging probe for 5-HT6 receptors.EBI
Bioorg Med Chem 19: 5255-9 (2011)
Columbia University Medical Center
Synthesis of rhodamine B-benzenesulfonamide conjugates and their inhibitory activity against humana- and bacterial/fungalß-carbonic anhydrases.EBI
Bioorg Med Chem Lett 21: 5210-3 (2011)
Ecole Nationale Sup£Rieure De Chimie De Montpellier
The natural product CCR5 antagonist anibamine and its analogs as anti-prostate cancer agents.EBI
Bioorg Med Chem Lett 21: 5159-63 (2011)
Virginia Commonwealth University
Biphenyl-3-yl alkylcarbamates as fatty acid amide hydrolase (FAAH) inhibitors: steric effects of N-alkyl chain on rat plasma and liver stability.EBI
Eur J Med Chem 46: 4466-73 (2011)
Universit£
Carbonic anhydrase inhibitors. Synthesis, molecular structures, and inhibition of the human cytosolic isozymes I and II and transmembrane isozymes IX, XII (cancer-associated) and XIV with novel 3-pyridinesulfonamide derivatives.EBI
Eur J Med Chem 46: 4403-10 (2011)
Medical University Of Gdansk
Discovery, synthesis, and biological evaluation of novel SMN protein modulators.EBI
J Med Chem 54: 6215-33 (2011)
National Human Genome Research Institute
Synthesis, molecular modeling and biological evaluation of chalcone thiosemicarbazide derivatives as novel anticancer agents.EBI
Eur J Med Chem 46: 4702-8 (2011)
Nanjing University
Synthesis and biological investigation of potential atypical antipsychotics with a tropane core. Part 1.EBI
Eur J Med Chem 46: 4474-88 (2011)
Medical University Of Warsaw
Inhibition of human carbonic anhydrase isozymes I, II and VI with a series of bisphenol, methoxy and bromophenol compounds.BDB
J Enzyme Inhib Med Chem 27: 467-75 (2012)
Artvin Coruh University
Design and characterization of a potent and selective dual ATP- and substrate-competitive subnanomolar bidentate c-Jun N-terminal kinase (JNK) inhibitor.EBI
J Med Chem 54: 6206-14 (2011)
Sanford-Burnham Medical Research Institute
Design and synthesis of brain penetrant selective JNK inhibitors with improved pharmacokinetic properties for the prevention of neurodegeneration.EBI
Bioorg Med Chem Lett 21: 5521-7 (2011)
Elan Pharmaceuticals
1,5-Disubstituted indole derivatives as selective human neuronal nitric oxide synthase inhibitors.EBI
Bioorg Med Chem Lett 21: 5301-4 (2011)
Neuraxon
Indolin-2-one p38a inhibitors II: Lead optimisation.EBI
Bioorg Med Chem Lett 21: 5270-3 (2011)
RhôNe-Poulenc Rorer
Structure based drug design of crizotinib (PF-02341066), a potent and selective dual inhibitor of mesenchymal-epithelial transition factor (c-MET) kinase and anaplastic lymphoma kinase (ALK).EBI
J Med Chem 54: 6342-63 (2011)
Pfizer
Improved synthesis of chiral pyrrolidine inhibitors and their binding properties to neuronal nitric oxide synthase.EBI
J Med Chem 54: 6399-403 (2011)
Northwestern University
3-benzhydryl-4-piperidones as novel neurokinin-1 receptor antagonists and their efficient synthesis.EBI
Bioorg Med Chem 19: 5175-82 (2011)
Takeda Pharmaceutical
A fast virtual screening approach to identify structurally diverse inhibitors of trypanothione reductase.EBI
Bioorg Med Chem Lett 21: 5255-8 (2011)
Universit£
Biochemical and pharmacological profiling of the pro-survival protein Bcl-xL.EBI
Bioorg Med Chem Lett 21: 4951-5 (2011)
University Of Washington
Synthesis and biochemical evaluation of triazole/tetrazole-containing sulfonamides against thrombin and related serine proteases.EBI
Bioorg Med Chem Lett 21: 5305-9 (2011)
The Johns Hopkins University
Synthesis and biological evaluation of glycogen synthase kinase 3 (GSK-3) inhibitors: an fast and atom efficient access to 1-aryl-3-benzylureas.EBI
Bioorg Med Chem Lett 21: 5610-5 (2011)
Technische Universit£T Darmstadt
4-Quinazolinyloxy-diaryl ureas as novel BRAFV600E inhibitors.EBI
Bioorg Med Chem Lett 21: 5342-6 (2011)
Ambit Biosciences
N-imidazolebenzyl-histidine substitution in somatostatin and in its octapeptide analogue modulates receptor selectivity and function.EBI
J Med Chem 54: 5981-7 (2011)
Salk Institute
Grassypeptolides F and G, cyanobacterial peptides from Lyngbya majuscula.EBI
J Nat Prod 74: 1686-91 (2011)
National Cancer Institute-Frederick
Structure-guided design and synthesis of P1' position 1-phenylcycloalkylamine-derived pentapeptidic BACE1 inhibitors.EBI
Bioorg Med Chem 19: 5238-46 (2011)
Kyoto Pharmaceutical University
Identification of a series of 4-[3-(quinolin-2-yl)-1,2,4-oxadiazol-5-yl]piperazinyl ureas as potent smoothened antagonist hedgehog pathway inhibitors.EBI
Bioorg Med Chem Lett 21: 5274-82 (2011)
Merck Research Laboratories
Acyclic nucleoside thiophosphonates as potent inhibitors of HIV and HBV replication.EBI
Eur J Med Chem 46: 4281-8 (2011)
Universit£S Aix-Marseille I Et Ii
Design of benzimidazole- and benzoxazole-2-thione derivatives as inhibitors of bacterial hyaluronan lyase.EBI
Eur J Med Chem 46: 4419-29 (2011)
University Of Regensburg
The discovery and synthesis of JNJ 31020028, a small molecule antagonist of the Neuropeptide Y Y2 receptor.EBI
Bioorg Med Chem Lett 21: 5552-6 (2011)
Johnson & Johnson Pharmaceutical Research & Development
Novel and highly potent histamine H3 receptor ligands. Part 1: withdrawing of hERG activity.EBI
Bioorg Med Chem Lett 21: 5378-83 (2011)
Bioprojet-Biotech
Novel series of pyrrolotriazine analogs as highly potent pan-Aurora kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 5296-300 (2011)
Ambit Biosciences
N-(2-alkylaminoethyl)-4-(1,2,4-oxadiazol-5-yl)piperazine-1-carboxamides as highly potent smoothened antagonists.EBI
Bioorg Med Chem Lett 21: 5283-8 (2011)
Merck Research Laboratories
Discovery of atrop fixed alkoxy-aminobenzhydrol derivatives: novel, highly potent and orally efficacious squalene synthase inhibitors.EBI
Bioorg Med Chem 19: 5207-24 (2011)
Daiichi Sankyo
Synthesis and molecular modeling of 1H-pyrrolopyrimidine-2,4-dione derivatives as ligands for thea1-adrenoceptors.EBI
Bioorg Med Chem 19: 5260-76 (2011)
Universit£
Novel aminopeptidase N (APN/CD13) inhibitors derived from chloramphenicol amine.EBI
Bioorg Med Chem 19: 5190-8 (2011)
Shandong University
Pyrazolopyridine inhibitors of B-RafV600E. Part 2: structure-activity relationships.EBI
Bioorg Med Chem Lett 21: 5533-7 (2011)
Arraybiopharma
Strategies to lower the Pgp efflux liability in a series of potent indole azetidine MCHR1 antagonists.EBI
Bioorg Med Chem Lett 21: 5310-4 (2011)
Lundbeck Research Usa
Synthesis, molecular docking and evaluation of thiazolyl-pyrazoline derivatives as EGFR TK inhibitors and potential anticancer agents.EBI
Bioorg Med Chem Lett 21: 5374-7 (2011)
Nanjing University
High-throughput kinase profiling: a more efficient approach toward the discovery of new kinase inhibitors.BDB
Chem Biol 18: 868-79 (2011)
Harvard Medical School
Design of HIV-1 protease inhibitors with C3-substituted hexahydrocyclopentafuranyl urethanes as P2-ligands: synthesis, biological evaluation, and protein-ligand X-ray crystal structure.EBI
J Med Chem 54: 5890-901 (2011)
Purdue University
Lignan derivatives from Krameria lappacea roots inhibit acute inflammation in vivo and pro-inflammatory mediators in vitro.EBI
J Nat Prod 74: 1779-86 (2011)
University Of Innsbruck
Biotinylated quercetin as an intrinsic photoaffinity proteomics probe for the identification of quercetin target proteins.EBI
Bioorg Med Chem 19: 4710-20 (2011)
Washington University
Thiolactone modulators of quorum sensing revealed through library design and screening.EBI
Bioorg Med Chem 19: 4820-8 (2011)
University Of Wisconsin-Madison
Discovery of GSK1997132B a novel centrally penetrant benzimidazole PPAR¿ partial agonist.EBI
Bioorg Med Chem Lett 21: 5568-72 (2011)
Glaxosmithkline
Design, synthesis, and biological evaluation of pyrazolopyrimidine-sulfonamides as potent multiple-mitotic kinase (MMK) inhibitors (part I).EBI
Bioorg Med Chem Lett 21: 5633-7 (2011)
Biogen Idec
Multi-target strategy to address Alzheimer's disease: design, synthesis and biological evaluation of new tacrine-based dimers.EBI
Eur J Med Chem 46: 4336-43 (2011)
Institut F£R Molekulare Physiologie
Structure-activity relationship and pharmacokinetic studies of sotrastaurin (AEB071), a promising novel medicine for prevention of graft rejection and treatment of psoriasis.EBI
J Med Chem 54: 6028-39 (2011)
Novartis Institutes For Biomedical Research
SAR by interligand nuclear overhauser effects (ILOEs) based discovery of acylsulfonamide compounds active against Bcl-x(L) and Mcl-1.EBI
J Med Chem 54: 6000-13 (2011)
Sanford-Burnham Medical Research Institute
Thermodynamic and biological evaluation of a thrombin binding aptamer modified with several unlocked nucleic acid (UNA) monomers and a 2'-C-piperazino-UNA monomer.EBI
Bioorg Med Chem 19: 4739-45 (2011)
University Of Southern Denmark
Design, synthesis and biological evaluation of novel nitroaromatic compounds as potent glutathione reductase inhibitors.EBI
Bioorg Med Chem Lett 21: 5398-402 (2011)
Batman University
Imidazo[2,1-b]thiazole guanylhydrazones as RSK2 inhibitors.EBI
Eur J Med Chem 46: 4311-23 (2011)
Universit£
Thailandepsins: bacterial products with potent histone deacetylase inhibitory activities and broad-spectrum antiproliferative activities.EBI
J Nat Prod 74: 2031-8 (2011)
University Of Wisconsin-Milwaukee
A disalicylic acid-furanyl derivative inhibits ephrin binding to a subset of Eph receptors.BDB
Chem Biol Drug Des 78: 667-78 (2011)
Sanford-Burnham Medical Research Institute
Synthesis and evaluation of novel carbon-11 labeled oxopurine analogues for positron emission tomography imaging of translocator protein (18 kDa) in peripheral organs.EBI
J Med Chem 54: 6040-9 (2011)
National Institute Of Radiological Sciences
Ligand-based modelling followed by synthetic exploration unveil novel glycogen phosphorylase inhibitory leads.EBI
Bioorg Med Chem 19: 4746-71 (2011)
Applied Science University
N-Arylalkyl-2-azaadamantanes as cage-expanded polycarbocyclic sigma (s) receptor ligands.EBI
Bioorg Med Chem Lett 21: 5289-92 (2011)
The University Of Sydney
Synthesis and antimicrobial activity of N¹-benzyl or N¹-benzyloxy-1,6-dihydro-1,3,5-triazine-2,4-diamines.EBI
Bioorg Med Chem Lett 21: 5428-31 (2011)
Huazhong University Of Science And Technology
Structure selectivity relationship studies of 17-cyclopropylmethyl-3,14ß-dihydroxy-4,5a-epoxy-6ß-[(4'-pyridyl)carboxamido]morphinan derivatives toward the development of the mu opioid receptor antagonists.EBI
Bioorg Med Chem Lett 21: 5625-9 (2011)
Virginia Commonwealth University
Identification of a non-phosphorylated, cell permeable, small molecule ligand for the Stat3 SH2 domain.EBI
Bioorg Med Chem Lett 21: 5605-9 (2011)
University Of Toronto Mississauga
Structure-based design and synthesis of 1,3-oxazinan-2-one inhibitors of 11ß-hydroxysteroid dehydrogenase type 1.EBI
J Med Chem 54: 6050-62 (2011)
Vitae Pharmaceuticals
Synthesis and in vitro evaluation of derivatives of theß¿?-adrenergic receptor antagonist HX-CH 44.EBI
Bioorg Med Chem Lett 21: 5506-9 (2011)
University Of Toronto
SAR analysis of innovative selective small molecule antagonists of sphingosine-1-phosphate 4 (S1P4) receptor.EBI
Bioorg Med Chem Lett 21: 5470-4 (2011)
The Scripps Research Institute
Overcoming hERG activity in the discovery of a series of 4-azetidinyl-1-aryl-cyclohexanes as CCR2 antagonists.EBI
Bioorg Med Chem Lett 21: 5577-82 (2011)
Johnson & Johnson Pharmaceutical Research And Development
Novel and highly potent histamine H3 receptor ligands. Part 2: exploring the cyclohexylamine-based series.EBI
Bioorg Med Chem Lett 21: 5384-8 (2011)
Bioprojet-Biotech
2-Phenyl and 2-heterocyclic-4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridines as inhibitors of TGF-ß1 and activin A signalling.EBI
Bioorg Med Chem Lett 21: 5642-5 (2011)
Monash University
Oxadiazole derivatives containing 1,4-benzodioxan as potential immunosuppressive agents against RAW264.7 cells.EBI
Bioorg Med Chem 19: 4895-902 (2011)
Nanjing University
Synthesis and evaluation of novel 2-butyl-4-chloro-1-methylimidazole embedded chalcones and pyrazoles as angiotensin converting enzyme (ACE) inhibitors.EBI
Bioorg Med Chem 19: 4772-81 (2011)
India Institute Of Chemical Technology
LuxR dependent quorum sensing inhibition by N,N'-disubstituted imidazolium salts.EBI
Bioorg Med Chem 19: 4868-75 (2011)
Insa Lyon
Lipid and sulfur substituted prenylcysteine analogs as human Icmt inhibitors.EBI
Bioorg Med Chem Lett 21: 5616-9 (2011)
Purdue University
Identification of pyridazin-3-one derivatives as potent, selective histamine H3 receptor inverse agonists with robust wake activity.EBI
Bioorg Med Chem Lett 21: 5493-7 (2011)
Cephalon
Monosubstituted¿-lactam and conformationally constrained 1,3-diaminopropan-2-ol transition-state isostere inhibitors ofß-secretase (BACE).EBI
Bioorg Med Chem Lett 21: 6916-24 (2011)
Bristol-Myers Squibb
N-Heteroaryl glycinamides and glycinamines as potent NPY5 antagonists.EBI
Bioorg Med Chem Lett 21: 5573-6 (2011)
Lundbeck Research Usa
Fragment library screening reveals remarkable similarities between the G protein-coupled receptor histamine H4 and the ion channel serotonin 5-HT3A.EBI
Bioorg Med Chem Lett 21: 5460-4 (2011)
Vu University Amsterdam
Discovery of Lu AA33810: a highly selective and potent NPY5 antagonist with in vivo efficacy in a model of mood disorder.EBI
Bioorg Med Chem Lett 21: 5436-41 (2011)
Lundbeck Research Usa
Exploring Left-Hand-Side substitutions in the benzoxazinone series of 4-amino-piperidine bacterial type IIa topoisomerase inhibitors.EBI
Bioorg Med Chem Lett 21: 5432-5 (2011)
Astrazeneca R&D Boston
Discovery, synthesis and SAR of azinyl- and azolylbenzamides antagonists of the P2X7 receptor.EBI
Bioorg Med Chem Lett 21: 5475-9 (2011)
Pfizer
A novel binding assay identifies high affinity ligands to the rosiglitazone binding site of mitoNEET.EBI
Bioorg Med Chem Lett 21: 5498-501 (2011)
Northeast Ohio Medical University
Synthesis and preliminary evaluation of a modified estradiol-core bearing a fused¿-lactone as non-estrogenic inhibitor of 17ß-hydroxysteroid dehydrogenase type 1.EBI
Bioorg Med Chem Lett 21: 5510-3 (2011)
Chuq - Research Center And Laval University
Optimization of cellular activity of G9a inhibitors 7-aminoalkoxy-quinazolines.EBI
J Med Chem 54: 6139-50 (2011)
University Of North Carolina At Chapel Hill
Remarkable potential of thea-aminophosphonate/phosphinate structural motif in medicinal chemistry.EBI
J Med Chem 54: 5955-80 (2011)
Wroclaw University Of Technology
A prodrug approach for improving antituberculosis activity of potent Mycobacterium tuberculosis type II dehydroquinase inhibitors.EBI
J Med Chem 54: 6063-84 (2011)
Universidad De Santiago De Compostela
Intramolecular ion-pair prodrugs of zanamivir and guanidino-oseltamivir.EBI
Bioorg Med Chem 19: 4796-802 (2011)
National Taiwan University
Inhibition of monoamine oxidase by C5-substituted phthalimide analogues.EBI
Bioorg Med Chem 19: 4829-40 (2011)
North-West University
Design of HIV-1 integrase inhibitors targeting the catalytic domain as well as its interaction with LEDGF/p75: a scaffold hopping approach using salicylate and catechol groups.EBI
Bioorg Med Chem 19: 4935-52 (2011)
Chinese Academy Of Sciences
Phosphopeptides with improved cellular uptake properties as ligands for the polo-box domain of polo-like kinase 1.EBI
Bioorg Med Chem Lett 21: 4686-9 (2011)
Helmholtz Center Dresden-Rossendorf
Refinement of arylthiosemicarbazone pharmacophore in inhibition of mushroom tyrosinase.EBI
Eur J Med Chem 46: 4330-5 (2011)
Universit£
The selective P-TEFb inhibitor CAN508 targets angiogenesis.EBI
Eur J Med Chem 46: 4289-94 (2011)
Palack£
3-Acetyl-2,5-diaryl-2,3-dihydro-1,3,4-oxadiazoles: a new scaffold for the selective inhibition of monoamine oxidase B.EBI
J Med Chem 54: 6394-8 (2011)
University Of Cagliari
Synthesis, in vivo occupancy, and radiolabeling of potent phosphodiesterase subtype-10 inhibitors as candidates for positron emission tomography imaging.EBI
J Med Chem 54: 5820-35 (2011)
Janssen-Cilag
Effects ofß-glucosidase hydrolyzed products of harpagide and harpagoside on cyclooxygenase-2 (COX-2) in vitro.EBI
Bioorg Med Chem 19: 4882-6 (2011)
Shanghai University Of Traditional Chinese Medicine
Bivalent ligand approach on N-{2-[(3-methoxyphenyl)methylamino]ethyl}acetamide: synthesis, binding affinity and intrinsic activity for MT(1) and MT(2) melatonin receptors.EBI
Bioorg Med Chem 19: 4910-6 (2011)
Universit£
Discovery of novel imidazo[1,2-a]pyridines as inhibitors of the insulin-like growth factor-1 receptor tyrosine kinase.EBI
Bioorg Med Chem Lett 21: 4698-701 (2011)
Astrazeneca
Synthesis and structure-activity relationship of novel conformationally restricted analogues of serotonin as 5-HT6 receptor ligands.BDB
J Enzyme Inhib Med Chem 27: 443-50 (2012)
Suven Life Sciences
Biotransformation of dehydroepiandrosterone with Macrophomina phaseolina and ß-glucuronidase inhibitory activity of transformed products.BDB
J Enzyme Inhib Med Chem 27: 348-55 (2012)
University Of Karachi
Targeting the prostaglandin F2a receptor for preventing preterm labor with azapeptide tocolytics.EBI
J Med Chem 54: 6085-97 (2011)
Mcgill University Health Center Research Institute
Synthesis of a novel series of L-isoserine derivatives as aminopeptidase N inhibitors.BDB
J Enzyme Inhib Med Chem 27: 302-10 (2012)
Shandong University
Ethyl malonate amides: a diketo acid offspring fragment for HIV integrase inhibition.EBI
Bioorg Med Chem 19: 5000-5 (2011)
University Of Silesia
Optimization of a pyrazole hit from FBDD into a novel series of indazoles as ketohexokinase inhibitors.EBI
Bioorg Med Chem Lett 21: 4762-7 (2011)
Johnson & Johnson Pharmaceutical Research And Development
Screening for GPCR Ligands Using Surface Plasmon Resonance.EBI
ACS Med Chem Lett 2: 549-554 (2011)
TBA
Serendipitous alkylation of a Plk1 ligand uncovers a new binding channel.BDB
Nat Chem Biol 7: 595-601 (2011)
National Cancer Institute-Frederick
N-substituted homopiperazine barbiturates as gelatinase inhibitors.EBI
Bioorg Med Chem 19: 4985-99 (2011)
Trinity College
Shishicrellastatins, inhibitors of cathepsin B, from the marine sponge Crella (Yvesia) spinulata.EBI
Bioorg Med Chem 19: 6594-8 (2011)
The University Of Tokyo
Identification of 2-(4-pyridyl)thienopyridinones as GSK-3ß inhibitors.EBI
Bioorg Med Chem Lett 21: 4823-7 (2011)
Glaxosmithkline
Identification of 3-aminomethyl-1,2-dihydro-4-phenyl-1-isoquinolones: a new class of potent, selective, and orally active non-peptide dipeptidyl peptidase IV inhibitors that form a unique interaction with Lys554.EBI
Bioorg Med Chem 19: 4953-70 (2011)
Takeda Pharmaceutical
Novel imidazo[1,2-a]pyridine based inhibitors of the IGF-1 receptor tyrosine kinase: optimization of the aniline.EBI
Bioorg Med Chem Lett 21: 4702-4 (2011)
Astrazeneca
Special ergolines efficiently inhibit the chemokine receptor CXCR3 in blood.EBI
Bioorg Med Chem Lett 21: 4745-9 (2011)
Novartis Institutes For Biomedical Research
The discovery and development of inhibitors of fatty acid amide hydrolase (FAAH).EBI
Bioorg Med Chem Lett 21: 4674-85 (2011)
The Scripps Research Institute
Design and synthesis of 2-phenylimidazo[1,2-a]pyridines as a novel class of melatonin receptor ligands.EBI
Eur J Med Chem 46: 4252-7 (2011)
Universit£
The combination of 4-anilinoquinazoline and cinnamic acid: a novel mode of binding to the epidermal growth factor receptor tyrosine kinase.EBI
Bioorg Med Chem 19: 5012-22 (2011)
Nanjing University
NSAID-derived ?-secretase modulation requires an acidic moiety on the carbazole scaffold.EBI
Bioorg Med Chem 19: 4903-9 (2011)
Technische Universit£T Darmstadt
Identification of 2-oxatriazines as highly potent pan-PI3K/mTOR dual inhibitors.EBI
Bioorg Med Chem Lett 21: 4773-8 (2011)
Pfizer
Inhibition studies of theß-carbonic anhydrases from the bacterial pathogen Salmonella enterica serovar Typhimurium with sulfonamides and sulfamates.EBI
Bioorg Med Chem 19: 5023-30 (2011)
Kochi Medical School
Evaluation of influence of Ap4A analogues on Fhit-positive HEK293T cells; cytotoxicity and ability to induce apoptosis.EBI
Bioorg Med Chem 19: 5053-60 (2011)
Polish Academy Of Sciences
Thrombin inhibitors with lipid peroxidation and lipoxygenase inhibitory activities.EBI
Bioorg Med Chem Lett 21: 4705-9 (2011)
University Of Ljubljana
New substrate analogue furin inhibitors derived from 4-amidinobenzylamide.EBI
Bioorg Med Chem Lett 21: 4695-7 (2011)
Philipps University Marburg
6-Aryl-3-pyrrolidinylpyridines as mGlu5 receptor negative allosteric modulators.EBI
Bioorg Med Chem Lett 21: 4891-9 (2011)
Lundbeck Research Usa
Conformationally constrained peptides from CD2 to modulate protein-protein interactions between CD2 and CD58.EBI
J Med Chem 54: 5307-19 (2011)
University Of Louisiana At Monroe
Design, synthesis and biological evaluation of urea derivatives from o-hydroxybenzylamines and phenylisocyanate as potential FabH inhibitors.EBI
Bioorg Med Chem 19: 4413-20 (2011)
Nanjing University
A mechanism-based potent sirtuin inhibitor containing Ne-thiocarbamoyl-lysine (TuAcK).EBI
Bioorg Med Chem Lett 21: 4753-7 (2011)
University Of Akron
Synthesis and antiglycation potentials of bergenin derivatives.EBI
Bioorg Med Chem Lett 21: 4928-31 (2011)
India Institute Of Chemical Technology
Bioactive sulfoximines: syntheses and properties of Vioxx analogs.EBI
Bioorg Med Chem Lett 21: 4888-90 (2011)
Rwth Aachen University
Discovery of novel fatty acid synthase (FAS) inhibitors based on the structure of ketoaceyl synthase (KS) domain.EBI
Bioorg Med Chem Lett 21: 4742-4 (2011)
Sichuan University
New insight into the central benzodiazepine receptor-ligand interactions: design, synthesis, biological evaluation, and molecular modeling of 3-substituted 6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepines and related compounds.EBI
J Med Chem 54: 5694-711 (2011)
Universit£
Evolution from a natural flavones nucleus to obtain 2-(4-Propoxyphenyl)quinoline derivatives as potent inhibitors of the S. aureus NorA efflux pump.EBI
J Med Chem 54: 5722-36 (2011)
Universita` Degli Studi Di Perugia
Synthesis, kinetic evaluation and cell-based analysis of C-alkylated isofagomines as chaperones of β-glucocerebrosidase.BDB
Chembiochem 12: 2151-4 (2011)
University Of British Columbia
Synthesis and biological evaluation of piperamide analogues as HDAC inhibitors.EBI
Bioorg Med Chem Lett 21: 4844-6 (2011)
East China Normal University
Click to a focused library of benzyl 6-triazolo(hydroxy)benzoic glucosides: novel construction of PTP1B inhibitors on a sugar scaffold.EBI
Eur J Med Chem 46: 4212-8 (2011)
East China University Of Science And Technology
Fluorescent derivatives ofs receptor ligand 1-cyclohexyl-4-[3-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine (PB28) as a tool for uptake and cellular localization studies in pancreatic tumor cells.EBI
J Med Chem 54: 5858-67 (2011)
Universita` Degli Studi Di Bari Aldo Moro
Design and discovery of a selective small molecule¿ opioid antagonist (2-methyl-N-((2'-(pyrrolidin-1-ylsulfonyl)biphenyl-4-yl)methyl)propan-1-amine, PF-4455242).EBI
J Med Chem 54: 5868-77 (2011)
Pfizer
Discovery of vinylogous carbamates as a novel class ofß-ketoacyl-acyl carrier protein synthase III (FabH) inhibitors.EBI
Bioorg Med Chem 19: 4454-9 (2011)
Soochow University
The design, synthesis and structure-activity relationships of novel isoindoline-based histone deacetylase inhibitors.EBI
Bioorg Med Chem Lett 21: 4909-12 (2011)
Novartis Institutes For Biomedical Research
Pyridine-derived ?-secretase modulators.EBI
Bioorg Med Chem Lett 21: 4832-5 (2011)
Glaxosmithkline Pharmaceuticals
Structure-activity relationship and docking studies of thiazolidinedione-type compounds with monoamine oxidase B.EBI
Bioorg Med Chem Lett 21: 4798-803 (2011)
Northeastern Ohio Universities Colleges Of Medicine And Pharmacy
Discovery of indazoles as inhibitors of Tpl2 kinase.EBI
Bioorg Med Chem Lett 21: 4758-61 (2011)
Pfizer
Peptoid ligands that bind selectively to phosphoproteins.EBI
Bioorg Med Chem Lett 21: 4960-4 (2011)
The Scripps Research Institute
Benzothiazole-based N-(phenylsulfonyl)amides as a novel family of PPARa antagonists.EBI
Bioorg Med Chem Lett 21: 4869-72 (2011)
Universit£
Design, synthesis and evaluation of N-benzoylindazole derivatives and analogues as inhibitors of human neutrophil elastase.EBI
Bioorg Med Chem 19: 4460-72 (2011)
Universit£
Discovery of potent, selective, and orally bioavailable quinoline-based dipeptidyl peptidase IV inhibitors targeting Lys554.EBI
Bioorg Med Chem 19: 4482-98 (2011)
Takeda Pharmaceutical
Fragmental modeling of hPepT2 and analysis of its binding features by docking studies and pharmacophore mapping.EBI
Bioorg Med Chem 19: 4544-51 (2011)
Universit£
Development of substrate analogue inhibitors for the human airway trypsin-like protease HAT.EBI
Bioorg Med Chem Lett 21: 4860-4 (2011)
Philipps University Marburg
Design and pharmacological evaluation of PF-4840154, a non-electrophilic reference agonist of the TrpA1 channel.EBI
Bioorg Med Chem Lett 21: 4857-9 (2011)
Pfizer
Structure-activity relationship studies of novel pyrazole and imidazole carboxamides as cannabinoid-1 (CB1) antagonists.EBI
Bioorg Med Chem Lett 21: 4913-8 (2011)
Dr. Reddy'S Laboratories
Synthesis, molecular modeling and biological evaluation ofß-ketoacyl-acyl carrier protein synthase III (FabH) as novel antibacterial agents.EBI
Bioorg Med Chem 19: 4513-9 (2011)
Nanjing University
Arthrinins A-D: novel diterpenoids and further constituents from the sponge derived fungus Arthrinium sp.EBI
Bioorg Med Chem 19: 4644-51 (2011)
Heinrich Heine Universit£T
Development of 3-substituted-androsterone derivatives as potent inhibitors of 17ß-hydroxysteroid dehydrogenase type 3.EBI
Bioorg Med Chem 19: 4652-68 (2011)
Chuq (Chul)-Research Center
Biphenyl/diphenyl ether renin inhibitors: filling the S1 pocket of renin via the S3 pocket.EBI
Bioorg Med Chem Lett 21: 4836-43 (2011)
Vitae Pharmaceuticals
Synthesis of 6-[¹8F]fluoro-PBR28, a novel radiotracer for imaging the TSPO 18 kDa with PET.EBI
Bioorg Med Chem Lett 21: 4819-22 (2011)
Cea
Synthesis and structural studies of pentacycloundecane-based HIV-1 PR inhibitors: a hybrid 2D NMR and docking/QM/MM/MD approach.EBI
Eur J Med Chem 46: 3976-85 (2011)
University Of Kwazulu-Natal
A screening assay for neuraminidase inhibitors using neuraminidases N1 and N3 from a baculovirus expression system.BDB
J Enzyme Inhib Med Chem 27: 5-11 (2012)
Chulalongkorn University
In vitro effects of some drugs on human erythrocyte glutathione reductase.BDB
J Enzyme Inhib Med Chem 27: 18-23 (2012)
Ataturk University
Designing modulators of dimethylarginine dimethylaminohydrolase (DDAH): a focus on selectivity over arginase.BDB
J Enzyme Inhib Med Chem 27: 24-8 (2012)
Christian-Albrechts-University
Discovery of potent and selective inhibitors of human platelet-type 12- lipoxygenase.EBI
J Med Chem 54: 5485-97 (2011)
National Human Genome Research Institute
Synthesis and pharmacological characterization of bicyclic triple reuptake inhibitor 3-aryl octahydrocyclopenta[c]pyrrole analogues.EBI
J Med Chem 54: 5283-95 (2011)
Sunovion Pharmaceuticals
Synthesis, in vitro and in vivo evaluation of fluorine-18 labelled FE-GW405833 as a PET tracer for type 2 cannabinoid receptor imaging.EBI
Bioorg Med Chem 19: 4499-505 (2011)
Imir K.U. Leuven
Discovery of selective indole-based prostaglandin D2 receptor antagonist.EBI
Bioorg Med Chem 19: 4574-88 (2011)
Minase Research Institute
Identification of MK-5710 ((8aS)-8a-methyl-1,3-dioxo-2-[(1S,2R)-2-phenylcyclopropyl]-N-(1-phenyl-1H-pyrazol-5-yl)hexahydroimid azo[1,5-a]pyrazine-7(1H)-carboxamide), a potent smoothened antagonist for use in Hedgehog pathway dependent malignancies, part 1.EBI
Bioorg Med Chem Lett 21: 4422-8 (2011)
Merck Research Laboratories
C-aryl glucosides substituted at the 4'-position as potent and selective renal sodium-dependent glucose co-transporter 2 (SGLT2) inhibitors for the treatment of type 2 diabetes.EBI
Bioorg Med Chem Lett 21: 4465-70 (2011)
Chinese Academy Of Sciences
Discovery and synthesis of a new class of opioid ligand having a 3-azabicyclo[3.1.0]hexane core. An example of a 'magic methyl' giving a 35-fold improvement in binding.EBI
Bioorg Med Chem Lett 21: 4608-11 (2011)
Pfizer
Identification of MK-5710 ((8aS)-8a-methyl-1,3-dioxo-2-[(1S,2R)-2-phenylcyclo- propyl]-N-(1-phenyl-1H-pyrazol-5-yl)hexahydro-imidazo[1,5-a]pyrazine-7(1H)-carboxamide), a potent smoothened antagonist for use in Hedgehog pathway dependent malignancies, part 2.EBI
Bioorg Med Chem Lett 21: 4429-35 (2011)
Merck Research Laboratories
Requirements for mammalian carboxylesterase inhibition by substituted ethane-1,2-diones.EBI
Bioorg Med Chem 19: 4635-43 (2011)
St. Jude Children'S Research Hospital
Design, synthesis and biological evaluation of tyrosine-based hydroxamic acid analogs as novel histone deacetylases (HDACs) inhibitors.EBI
Bioorg Med Chem 19: 4437-44 (2011)
Shandong University
Development of potent B-RafV600E inhibitors containing an arylsulfonamide headgroup.EBI
Bioorg Med Chem Lett 21: 4436-40 (2011)
Glaxosmithkline
Azepanone-based inhibitors of human cathepsin S: optimization of selectivity via the P2 substituent.EBI
Bioorg Med Chem Lett 21: 4409-15 (2011)
Glaxosmithkline
Nothospondin, a new AP-1 inhibitory quassinoid from the Cameroonian plant Nothospondias staudtii.EBI
Bioorg Med Chem Lett 21: 4397-9 (2011)
Nci-Frederick
Benzimidazolone as potent chymase inhibitor: modulation of reactive metabolite formation in the hydrophobic (P1) region.EBI
Bioorg Med Chem Lett 21: 4533-9 (2011)
Boehringer Ingelheim Pharmaceuticals
Structure-activity study on a series ofa-glutamic acid scaffold based compounds as new ADAMTS inhibitors.EBI
Bioorg Med Chem Lett 21: 4457-61 (2011)
Chinese Academy Of Sciences
Polysulfated xanthones: multipathway development of a new generation of dual anticoagulant/antiplatelet agents.EBI
J Med Chem 54: 5373-84 (2011)
Universidade Do Porto (Cequimed-Up)
Synthesis and in vitro biological evaluation of carbonyl group-containing analogues fors1 receptors.EBI
J Med Chem 54: 5362-72 (2011)
Washington University
Binding ofa,a-disubstituted amino acids to arginase suggests new avenues for inhibitor design.EBI
J Med Chem 54: 5432-43 (2011)
Drexel University
Mechanism of inhibition of fatty acid amide hydrolase by sulfonamide-containing benzothiazoles: long residence time derived from increased kinetic barrier and not exclusively from thermodynamic potency.BDB
Biochemistry 50: 6867-78 (2011)
Astrazeneca Pharmaceuticals
New anthranilic acid based antagonists with high affinity and selectivity for the human cholecystokinin receptor 1 (hCCK1-R).EBI
J Med Chem 54: 5769-85 (2011)
University Of Trieste
The lipogenesis pathway as a cancer target.EBI
J Med Chem 54: 5615-38 (2011)
Wayne State University
Tryptophan 2,3-dioxygenase (TDO) inhibitors. 3-(2-(pyridyl)ethenyl)indoles as potential anticancer immunomodulators.EBI
J Med Chem 54: 5320-34 (2011)
University Of Namur
Discovery of benzimidazole derivatives as novel multi-target EGFR, VEGFR-2 and PDGFR kinase inhibitors.EBI
Bioorg Med Chem 19: 4529-35 (2011)
Tsinghua University
Pharmacophore modeling and virtual screening to identify potential RET kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 4490-7 (2011)
National Tsing Hua University
Rigidized 1-aryl sulfonyl tryptamines: synthesis and pharmacological evaluation as 5-HT6 receptor ligands.EBI
Bioorg Med Chem Lett 21: 4577-80 (2011)
Suven Life Sciences
Photosynthesis-Inhibiting efficiency of 4-chloro-2-(chlorophenylcarbamoyl)phenyl alkylcarbamates.EBI
Bioorg Med Chem Lett 21: 4564-7 (2011)
University Of Pardubice
Synthesis and Na+/H+ exchanger inhibitory activity of benzoylguanidine derivatives.EBI
Eur J Med Chem 46: 4107-16 (2011)
China Pharmaceutical University
Human HDAC isoform selectivity achieved via exploitation of the acetate release channel with structurally unique small molecule inhibitors.EBI
Bioorg Med Chem 19: 4626-34 (2011)
Novartis Institutes For Biomedical Research
Discovery of potent, soluble and orally active TRPV1 antagonists. Structure-activity relationships of a series of isoxazoles.EBI
Bioorg Med Chem Lett 21: 4652-7 (2011)
Merck Research Laboratories
Design-driven LO: the discovery of new ultra long acting dibasicß2-adrenoceptor agonists.EBI
Bioorg Med Chem Lett 21: 4612-6 (2011)
Astrazeneca
Docking and 3D-QSAR (quantitative structure activity relationship) studies of flavones, the potent inhibitors of p-glycoprotein targeting the nucleotide binding domain.EBI
Eur J Med Chem 46: 4078-88 (2011)
Chosun University
N-ß-glycosyl sulfamides are selective inhibitors of the cancer associated carbonic anhydrase isoforms IX and XII.EBI
Bioorg Med Chem Lett 21: 4447-50 (2011)
Universidad Nacional De La Plata
Synthesis and SAR of new pyrazolo[4,3-h]quinazoline-3-carboxamide derivatives as potent and selective MPS1 kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 4507-11 (2011)
Nerviano Medical Sciences
In vivo PET imaging of histone deacetylases by 18F-suberoylanilide hydroxamic acid (18F-SAHA).EBI
J Med Chem 54: 5576-82 (2011)
Harvard Medical School
Identification of benzofuran-4,5-diones as novel and selective non-hydroxamic acid, non-peptidomimetic based inhibitors of human peptide deformylase.EBI
Bioorg Med Chem Lett 21: 4528-32 (2011)
Memorial Sloan-Kettering Cancer Center
Benzisothiazolones as modulators of macrophage migration inhibitory factor.EBI
Bioorg Med Chem Lett 21: 4545-9 (2011)
Yale University
Discovery of bacterial NAD+-dependent DNA ligase inhibitors: optimization of antibacterial activity.EBI
Bioorg Med Chem Lett 21: 4556-60 (2011)
Astrazeneca R&D Boston
Indolequinone inhibitors of NRH:quinone oxidoreductase 2. Characterization of the mechanism of inhibition in both cell-free and cellular systems.BDB
Biochemistry 50: 6678-88 (2011)
University Of Colorado Denver
Antitumor actinopyranones produced by Streptomyces albus POR-04-15-053 isolated from a marine sediment.EBI
J Nat Prod 74: 1590-6 (2011)
Pharmamar Sau
Ptilomycalin A inhibits laccase and melanization in Cryptococcus neoformans.EBI
Bioorg Med Chem 19: 6654-7 (2011)
University Of California
Discovery of a stable macrocyclic o-aminobenzamide Hsp90 inhibitor which significantly decreases tumor volume in a mouse xenograft model.EBI
Bioorg Med Chem Lett 21: 4602-7 (2011)
Pfizer
Synthesis and pharmacological assessment of diversely substituted pyrazolo[3,4-b]quinoline, and benzo[b]pyrazolo[4,3-g][1,8]naphthyridine derivatives.EBI
Eur J Med Chem 46: 4676-81 (2011)
University Of Lisbon
Discovery of a tetrahydroisoquinoline-based hydroxamic acid derivative (ZYJ-34c) as histone deacetylase inhibitor with potent oral antitumor activities.EBI
J Med Chem 54: 5532-9 (2011)
Shandong University
Rational design of potent, small, synthetic allosteric inhibitors of thrombin.EBI
J Med Chem 54: 5522-31 (2011)
Virginia Commonwealth University
Structure-activity relationships of phosphoinositide 3-kinase (PI3K)/mammalian target of rapamycin (mTOR) dual inhibitors: investigations of various 6,5-heterocycles to improve metabolic stability.EBI
J Med Chem 54: 5174-84 (2011)
Amgen
Synthesis and evaluation of aliphatic-chain hydroxamates capped with osthole derivatives as histone deacetylase inhibitors.EBI
Eur J Med Chem 46: 4042-9 (2011)
Taipei Medical University
Synthesis and significant cytostatic activity of 7-hetaryl-7-deazaadenosines.EBI
J Med Chem 54: 5498-507 (2011)
Academy Of Sciences Of The Czech Republic
Structure-activity relationship studies on isoindoline inhibitors of dipeptidyl peptidases 8 and 9 (DPP8, DPP9): is DPP8-selectivity an attainable goal?EBI
J Med Chem 54: 5737-46 (2011)
University Of Antwerp (Ua)
Understanding the origins of time-dependent inhibition by polypeptide deformylase inhibitors.BDB
Biochemistry 50: 6642-54 (2011)
Glaxosmithkline
Discovery and evaluation of 3-phenyl-1H-5-pyrazolylamine-based derivatives as potent, selective and efficacious inhibitors of FMS-like tyrosine kinase-3 (FLT3).EBI
Bioorg Med Chem 19: 4173-82 (2011)
National Health Research Institutes
Synthesis, biological evaluation and docking studies of octane-carboxamide based renin inhibitors with extended segments toward S3' site of renin.EBI
Bioorg Med Chem 19: 4238-49 (2011)
China Pharmaceutical University
Synthesis of an aryloxy oxo pyrimidinone library that displays ALK-selective inhibition.EBI
Bioorg Med Chem Lett 21: 4592-6 (2011)
St. Jude Children'S Research Hospital
Combination of pharmacophore model development and binding mode analyses: identification of ligand features essential for I¿B kinase-beta (IKKß) inhibitors and virtual screening based on it.EBI
Eur J Med Chem 46: 3942-52 (2011)
China Pharmaceutical University
Potent, metabolically stable benzopyrimido-pyrrolo-oxazine-dione (BPO) CFTR inhibitors for polycystic kidney disease.EBI
J Med Chem 54: 5468-77 (2011)
University Of California
From fragment screening to in vivo efficacy: optimization of a series of 2-aminoquinolines as potent inhibitors of beta-site amyloid precursor protein cleaving enzyme 1 (BACE1).EBI
J Med Chem 54: 5836-57 (2011)
Amgen
Phenylimino-10H-anthracen-9-ones as novel antimicrotubule agents-synthesis, antiproliferative activity and inhibition of tubulin polymerization.EBI
Bioorg Med Chem 19: 4183-91 (2011)
Westphalian Wilhelms-University
Discovery of imidazo[1,2-b]pyridazines as IKKß inhibitors. Part 3: exploration of effective compounds in arthritis models.EBI
Bioorg Med Chem Lett 21: 4550-5 (2011)
Daiichi Sankyo
Discovery of pyrrolo[2,1-f][1,2,4]triazine C6-ketones as potent, orally active p38a MAP kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 4633-7 (2011)
Bristol-Myers Squibb
Synthesis and in vitro evaluation of new analogues as inhibitors for phosphodiesterase 10A.EBI
Eur J Med Chem 46: 3986-95 (2011)
Washington University
The tandem chain extension aldol reaction used for synthesis of ketomethylene tripeptidomimetics targeting hPEPT1.EBI
Bioorg Med Chem Lett 21: 4597-601 (2011)
Biogen Idec
Synthesis and structure-activity relationship of 1- and 2-substituted-1,2,3-triazole letrozole-based analogues as aromatase inhibitors.EBI
Eur J Med Chem 46: 4010-24 (2011)
Universit£
Novel benzoxazine and benzothiazine derivatives as multifunctional antihyperlipidemic agents.EBI
J Med Chem 54: 5583-91 (2011)
University Of Athens
Investigations on the 4-quinolone-3-carboxylic acid motif. 4. Identification of new potent and selective ligands for the cannabinoid type 2 receptor with diverse substitution patterns and antihyperalgesic effects in mice.EBI
J Med Chem 54: 5444-53 (2011)
Universita Degli Studi Di Siena
Imidazo[1,2-a]pyridin-3-amines as potential HIV-1 non-nucleoside reverse transcriptase inhibitors.EBI
Bioorg Med Chem 19: 4227-37 (2011)
Csir Biosciences
Optimisation of pharmacokinetic properties to afford an orally bioavailable and selective V1A receptor antagonist.EBI
Bioorg Med Chem Lett 21: 4622-8 (2011)
Msd
Synthesis, antiviral activity, cytotoxicity and cellular pharmacology of l-3'-azido-2',3'-dideoxypurine nucleosides.EBI
Eur J Med Chem 46: 3832-44 (2011)
Veterans Affairs Medical Center
Identification of a small-molecule inhibitor of DNA topoisomerase II by proteomic profiling.BDB
Chem Biol 18: 743-51 (2011)
Riken Advanced Science Institute
Development of small molecule inhibitors and probes of human SUMO deconjugating proteases.BDB
Chem Biol 18: 722-32 (2011)
Stanford University
Effects of dopaminergic compounds on carbonic anhydrase isozymes I, II, and VI.BDB
J Enzyme Inhib Med Chem 27: 365-9 (2012)
Agri Ibrahim Cecen University
Design, synthesis, and biological evaluation of 3,4-dihydroquinolin-2(1H)-one and 1,2,3,4-tetrahydroquinoline-based selective human neuronal nitric oxide synthase (nNOS) inhibitors.EBI
J Med Chem 54: 5562-75 (2011)
Neuraxon
Modulation of GABAA-receptors by honokiol and derivatives: subtype selectivity and structure-activity relationship.EBI
J Med Chem 54: 5349-61 (2011)
University Of Vienna
Selectivity of kinase inhibitor fragments.EBI
J Med Chem 54: 5131-43 (2011)
Glaxosmithkline
The discovery of long-acting saligeninß2 adrenergic receptor agonists incorporating hydantoin or uracil rings.EBI
Bioorg Med Chem 19: 4192-201 (2011)
Glaxosmithkline
Generation of 'Unnatural Natural Product' library and identification of a small molecule inhibitor of XIAP.EBI
Bioorg Med Chem 19: 4377-85 (2011)
Keio University
Design, synthesis and biological evaluation of 2'-deoxy-2',2'-difluoro-5-halouridine phosphoramidate ProTides.EBI
Bioorg Med Chem 19: 4338-45 (2011)
Cardiff University
A novel HDAC inhibitor with a hydroxy-pyrimidine scaffold.EBI
Bioorg Med Chem Lett 21: 4164-9 (2011)
Broad Institute Of Harvard And Mit
N-Acylhydrazones as inhibitors of PDE10A.EBI
Bioorg Med Chem Lett 21: 4155-9 (2011)
Omeros
Pyrrolo[2,3-c]azepine derivatives: a new class of potent protein tyrosine phosphatase 1B inhibitors.EBI
Bioorg Med Chem Lett 21: 4306-9 (2011)
Sun Yat-Sen University
Pyrazole-based sulfonamide and sulfamides as potent inhibitors of mammalian 15-lipoxygenase.EBI
Bioorg Med Chem Lett 21: 4141-5 (2011)
Bristol-Myers Squibb Research And Development
Indolin-2-one p38a inhibitors I: design, profiling and crystallographic binding mode.EBI
Bioorg Med Chem Lett 21: 4130-3 (2011)
RhôNe-Poulenc Rorer
Synthesis and biological evaluation of 1-substituted-3(5)-(6-methylpyridin-2-yl)-4-(quinoxalin-6-yl)pyrazoles as transforming growth factor-ß type 1 receptor kinase inhibitors.EBI
Eur J Med Chem 46: 3917-25 (2011)
Ewha Womans University
Structure-guided lead optimization of triazolopyrimidine-ring substituents identifies potent Plasmodium falciparum dihydroorotate dehydrogenase inhibitors with clinical candidate potential.EBI
J Med Chem 54: 5540-61 (2011)
Glaxosmithkline
Identification of the binding modes of N-phenylphthalimides inhibiting bacterial thymidylate synthase through X-ray crystallography screening.EBI
J Med Chem 54: 5454-67 (2011)
Universita Degli Studi Di Modena E Reggio Emilia
Chromone, a privileged scaffold for the development of monoamine oxidase inhibitors.EBI
J Med Chem 54: 5165-73 (2011)
Universidade Do Porto
Discovery and structure-activity relationships of modified salicylanilides as cell permeable inhibitors of poly(ADP-ribose) glycohydrolase (PARG).EBI
J Med Chem 54: 5403-13 (2011)
University Of Arizona
Synthesis and structure-activity relationship of new 1,5-dialkyl-1,5-benzodiazepines as cholecystokinin-2 receptor antagonists.EBI
Bioorg Med Chem 19: 4257-73 (2011)
Glaxosmithkline
Generation of 3,8-substituted 1,2,4-triazolopyridines as potent inhibitors of human 11ß-hydroxysteroid dehydrogenase type 1 (11ß-HSD-1).EBI
Bioorg Med Chem Lett 21: 4146-9 (2011)
Bristol-Myers Squibb
Aryl 1,4-diazepane compounds as potent and selective CB2 agonists: optimization of drug-like properties and target independent parameters.EBI
Bioorg Med Chem Lett 21: 4276-80 (2011)
Boehringer Ingelheim Pharmaceuticals
Structural investigation into the inhibitory mechanisms of indomethacin and its analogues towards human glyoxalase I.EBI
Bioorg Med Chem Lett 21: 4243-7 (2011)
Sun Yat-Sen University
New, potent, selective, and short-acting peptidic V1a receptor agonists.EBI
J Med Chem 54: 4388-98 (2011)
Ferring Research Institute
Tricyclic thiazolopyrazole derivatives as metabotropic glutamate receptor 4 positive allosteric modulators.EBI
J Med Chem 54: 5070-81 (2011)
Lundbeck Research Usa
Bioanalytical Screening of Riboflavin Antagonists for Targeted Drug Delivery - A Thermodynamic and Kinetic Study.EBI
ACS Med Chem Lett 2: 363-367 (2011)
Calvin College
Synthesis of novel inhibitors of ?-glucuronidase based on benzothiazole skeleton and study of their binding affinity by molecular docking.EBI
Bioorg Med Chem 19: 4286-94 (2011)
University Of Karachi
Probes for narcotic receptor mediated phenomena. 43. Synthesis of the ortho-a and para-a, and improved synthesis and optical resolution of the ortho-b and para-b oxide-bridged phenylmorphans: compounds with moderate to low opioid-receptor affinity.EBI
Bioorg Med Chem 19: 4330-7 (2011)
National Institute On Drug Abuse And The National Institute On Alcohol Abuse And Alcoholism
MAO inhibitory activity modulation: 3-Phenylcoumarins versus 3-benzoylcoumarins.EBI
Bioorg Med Chem Lett 21: 4224-7 (2011)
Universidad De Santiago De Compostela
Discovery of microsomal triglyceride transfer protein (MTP) inhibitors with potential for decreased active metabolite load compared to dirlotapide.EBI
Bioorg Med Chem Lett 21: 4150-4 (2011)
Pfizer
Discovery of a novel class of 2-aminopyrimidines as CDK1 and CDK2 inhibitors.EBI
Bioorg Med Chem Lett 21: 4203-5 (2011)
Keimyung University
Arylamides hybrids of two high-affinitys2 receptor ligands as tools for the development of PET radiotracers.EBI
Eur J Med Chem 46: 4733-41 (2011)
Universit£
Novel nanomolar imidazo[4,5-b]pyridines as selective nitric oxide synthase (iNOS) inhibitors: SAR and structural insights.EBI
Bioorg Med Chem Lett 21: 4228-32 (2011)
Nycomed
Probing the difference between BH3 groove of Mcl-1 and Bcl-2 protein: Implications for dual inhibitors design.EBI
Eur J Med Chem 46: 3909-16 (2011)
Dalian University Of Technology
Synthesis and biological evaluation of novel 5-alkyl-2-arylthio-6-((3,4-dihydroquinolin-1(2H)-yl)methyl)pyrimidin-4(3H)-ones as potent non-nucleoside HIV-1 reverse transcriptase inhibitors.EBI
Bioorg Med Chem 19: 4366-76 (2011)
Shandong University
Application of Ullmann and Ullmann-Finkelstein reactions for the synthesis of N-aryl-N-(1H-pyrazol-3-yl) acetamide or N-(1-aryl-1H-pyrazol-3-yl) acetamide derivatives and pharmacological evaluation.EBI
Eur J Med Chem 46: 3867-76 (2011)
University Of Lille
Discovery of a selective allosteric M1 receptor modulator with suitable development properties based on a quinolizidinone carboxylic acid scaffold.EBI
J Med Chem 54: 4773-80 (2011)
Merck Research Laboratories
Biphenyl-substituted oxazolidinones as cholesteryl ester transfer protein inhibitors: modifications of the oxazolidinone ring leading to the discovery of anacetrapib.EBI
J Med Chem 54: 4880-95 (2011)
Merck Research Laboratories
Pyrazoline based MAO inhibitors: synthesis, biological evaluation and SAR studies.EBI
Bioorg Med Chem Lett 21: 4296-300 (2011)
Birla Institute Of Technology
Design, synthesis and evaluation of monovalent Smac mimetics that bind to the BIR2 domain of the anti-apoptotic protein XIAP.EBI
Bioorg Med Chem Lett 21: 4332-6 (2011)
Sanford-Burnham Medical Research Institute
Synthesis and biological evaluation of (±)-3-(2-(2-fluorobenzyloxy) naphthalen-6-yl)-2-aminopropanoic acid derivatives as novel PTP1B inhibitors.EBI
Eur J Med Chem 46: 3630-8 (2011)
Yanbian University
Acetaldehyde-derived modifications on cytosolic human carbonic anhydrases.BDB
J Enzyme Inhib Med Chem 26: 862-70 (2011)
University Of Tampere And Tampere University Hospital
Side chain SAR of bicyclicß-lactamase inhibitors (BLIs). 2. N-Alkylated and open chain analogs of MK-8712.EBI
Bioorg Med Chem Lett 21: 4267-70 (2011)
Merck Research Labs
Discovery of a novel series of nonacidic benzofuran EP1 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 4343-8 (2011)
Glaxosmithkline
New 2-heterocyclyl-imidazo[2,1-i]purin-5-one derivatives as potent and selective human A3 adenosine receptor antagonists.EBI
J Med Chem 54: 5205-20 (2011)
Universit£
Development of endocannabinoid-based chemical probes for the study of cannabinoid receptors.EBI
J Med Chem 54: 5265-9 (2011)
Universidad Complutense De Madrid
Triptolide directly inhibits dCTP pyrophosphatase.BDB
Chembiochem 12: 1767-73 (2011)
Yale University
Optimisation of a novel series of selective CNS penetrant CB(2) agonists.EBI
Bioorg Med Chem Lett 21: 4284-7 (2011)
Pfizer
Discovery of a new type inhibitor of human glyoxalase I by myricetin-based 4-point pharmacophore.EBI
Bioorg Med Chem Lett 21: 4337-42 (2011)
Tokyo University Of Science
Identification of non-amidine inhibitors of acid-sensing ion channel-3 (ASIC3).EBI
Bioorg Med Chem Lett 21: 4255-8 (2011)
Merck Research Laboratories
Small molecule inhibitors of SHP2 tyrosine phosphatase discovered by virtual screening.EBI
Bioorg Med Chem Lett 21: 4238-42 (2011)
Indiana University
In vitro inhibition ofa-carbonic anhydrase isozymes by some phenolic compounds.EBI
Bioorg Med Chem Lett 21: 4259-62 (2011)
Gumushane University
Selective non zinc binding inhibitors of MMP13.EBI
Bioorg Med Chem Lett 21: 4215-9 (2011)
Astrazeneca
Benzyl derivatives with in vitro binding affinity for human opioid and cannabinoid receptors from the fungus Eurotium repens.EBI
J Nat Prod 74: 1636-9 (2011)
The University Of Mississippi
Discovery of PF-04457845: A Highly Potent, Orally Bioavailable, and Selective Urea FAAH Inhibitor.EBI
ACS Med Chem Lett 2: 91-96 (2011)
Pfizer
Synthesis and Biological Evaluation of N-Fluoroalkyl and 2-Fluoroalkoxy Substituted Aporphines: Potential PET Ligands for Dopamine D(2) Receptors.EBI
ACS Med Chem Lett 2: 189-194 (2011)
Harvard Medical School
Synthesis and evaluation of fluorescent heterocyclic aminoadamantanes as multifunctional neuroprotective agents.EBI
Bioorg Med Chem 19: 3935-44 (2011)
North-West University
Discovery of novel c-Met kinase inhibitors bearing a thieno[2,3-d]pyrimidine or furo[2,3-d]pyrimidine scaffold.EBI
Bioorg Med Chem 19: 3906-18 (2011)
Chinese Academy Of Sciences
Evaluation of NTF1836 as an inhibitor of the mycothiol biosynthetic enzyme MshC in growing and non-replicating Mycobacterium tuberculosis.EBI
Bioorg Med Chem 19: 3956-64 (2011)
University Of California
Facile fabrication of promising protein tyrosine phosphatase (PTP) inhibitor entities based on 'clicked' serine/threonine-monosaccharide hybrids.EBI
Bioorg Med Chem 19: 3892-900 (2011)
East China University Of Science And Technology
Inhibition of a prolyl hydroxylase domain (PHD) by substrate analog peptides.EBI
Bioorg Med Chem Lett 21: 4325-8 (2011)
Korea Institute Of Science And Technology
Inhibition of the cellular function of perforin by 1-amino-2,4-dicyanopyrido[1,2-a]benzimidazoles.EBI
Bioorg Med Chem 19: 4091-100 (2011)
University Of Auckland
Synthesis, structural elucidation, DNA-PK inhibition, homology modelling and anti-platelet activity of morpholino-substituted-1,3-naphth-oxazines.EBI
Bioorg Med Chem 19: 3983-94 (2011)
La Trobe University
DNA-instructed acyl transfer reactions for the synthesis of bioactive peptides.EBI
Bioorg Med Chem Lett 21: 4993-7 (2011)
Humboldt Universit£T Zu Berlin
Synthesis and biological activity of tricyclic cycloalkylimidazo-, pyrimido- and diazepinopurinediones.EBI
Eur J Med Chem 46: 3590-607 (2011)
Jagiellonian University Medical College
Thiophenyl oxime-derived phosphonates as nano-molar class C beta-lactamase inhibitors reducing MIC of imipenem against Pseudomonas aeruginosa and Acinetobacter baumannii.EBI
Bioorg Med Chem Lett 21: 4363-5 (2011)
Merck
Synthesis and evaluation of highly potent GABA(A) receptor antagonists based on gabazine (SR-95531).EBI
Bioorg Med Chem Lett 21: 4252-4 (2011)
University College London
Single step synthesis of new fused pyrimidine derivatives and their evaluation as potent Aurora-A kinase inhibitors.EBI
Eur J Med Chem 46: 3690-5 (2011)
Umm Al-Qura University
Synthesis and antiviral evaluation ofa-L-2'-deoxythreofuranosyl nucleosides.EBI
Eur J Med Chem 46: 3704-13 (2011)
University Of Gent
Discovery and SAR of methylated tetrahydropyranyl derivatives as inhibitors of isoprenylcysteine carboxyl methyltransferase (ICMT).EBI
J Med Chem 54: 5031-47 (2011)
Myrexis
Development of a liver-targeted stearoyl-CoA desaturase (SCD) inhibitor (MK-8245) to establish a therapeutic window for the treatment of diabetes and dyslipidemia.EBI
J Med Chem 54: 5082-96 (2011)
Merck Frosst Centre For Therapeutic Research
Biophysical mapping of the adenosine A2A receptor.EBI
J Med Chem 54: 4312-23 (2011)
Heptares Therapeutics
Discovery of 4-[4-({(3R)-1-butyl-3-[(R)-cyclohexyl(hydroxy)methyl]-2,5-dioxo-1,4,9-triazaspiro[5.5]undec-9-yl}methyl)phenoxy]benzoic acid hydrochloride: a highly potent orally available CCR5 selective antagonist.EBI
Bioorg Med Chem 19: 4028-42 (2011)
Ono Pharmaceutical
Discovery of 1-{4-[1-(2,6-difluorobenzyl)-5-[(dimethylamino)methyl]-3-(6-methoxypyridazin-3-yl)-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidin-6-yl]phenyl}-3-methoxyurea (TAK-385) as a potent, orally active, non-peptide antagonist of the human gonadotropin-releasing hormone receptor.EBI
J Med Chem 54: 4998-5012 (2011)
Takeda Pharmaceutical
Synthesis and evaluation of 5-substituted 2'-deoxyuridine monophosphate analogues as inhibitors of flavin-dependent thymidylate synthase in Mycobacterium tuberculosis.EBI
J Med Chem 54: 4847-62 (2011)
Katholieke Universiteit Leuven
Design driven HtL: The discovery and synthesis of new high efficacyß2-agonists.EBI
Bioorg Med Chem Lett 21: 4027-31 (2011)
Astrazeneca
Backbone cyclic peptide inhibitors of protein kinase B (PKB/Akt).EBI
J Med Chem 54: 5154-64 (2011)
The Hebrew University Of Jerusalem
Synthesis and biological evaluation of novel thiazolidinedione analogues as 15-hydroxyprostaglandin dehydrogenase inhibitors.EBI
J Med Chem 54: 5260-4 (2011)
Chosun University
Optimization of the in vitro cardiac safety of hydroxamate-based histone deacetylase inhibitors.EBI
J Med Chem 54: 4752-72 (2011)
Novartis Institutes For Biomedical Research
Use of structure-based design to discover a potent, selective, in vivo active phosphodiesterase 10A inhibitor lead series for the treatment of schizophrenia.EBI
J Med Chem 54: 4536-47 (2011)
Pfizer
The relevance of higher plants in lead compound discovery programs.EBI
J Nat Prod 74: 1539-55 (2011)
The Ohio State University
Imidazolopiperazines: hit to lead optimization of new antimalarial agents.EBI
J Med Chem 54: 5116-30 (2011)
Genomics Institute Of The Novartis Research Foundation
N-fused imidazoles as novel anticancer agents that inhibit catalytic activity of topoisomerase IIa and induce apoptosis in G1/S phase.EBI
J Med Chem 54: 5013-30 (2011)
National Institute Of Pharmaceutical Education And Research (Niper)
Elucidation of New Binding Interactions with the Tumor Susceptibility Gene 101 (Tsg101) Protein Using Modified HIV-1 Gag-p6 Derived Peptide Ligands.EBI
ACS Med Chem Lett 2: 337-341 (2011)
Nci-Frederick
Synthesis of new opioid derivatives with a propellane skeleton and their pharmacology: part 1.EBI
Bioorg Med Chem Lett 21: 4104-7 (2011)
Kitasato University
Design, synthesis and biological activity of novel peptidyl benzyl ketone FVIIa inhibitors.EBI
Bioorg Med Chem Lett 21: 3918-22 (2011)
Technical University Of Denmark
Combined SVM-based and docking-based virtual screening for retrieving novel inhibitors of c-Met.EBI
Eur J Med Chem 46: 3675-80 (2011)
Sichuan University
Synthesis of novel triplet drugs with 1,3,5-trioxazatriquinane skeletons and their pharmacologies. 1: Synthesis of triplet drugs with morphinan skeletons.EBI
Bioorg Med Chem Lett 21: 4023-6 (2011)
Kitasato University
A diazen-1-ium-1,2-diolated nitric oxide donor ester prodrug of 3-(4-hydroxymethylphenyl)-4-(4-methanesulfonylphenyl)-5H-furan-2-one: synthesis, biological evaluation and nitric oxide release studies.EBI
Bioorg Med Chem Lett 21: 3951-6 (2011)
University Of Alberta
Discovery of S1P agonists with a dihydronaphthalene scaffold.EBI
Bioorg Med Chem Lett 21: 3885-9 (2011)
Ono Pharmaceutical
Phenyl isoxazole voltage-gated sodium channel blockers: structure and activity relationship.EBI
Bioorg Med Chem Lett 21: 3871-6 (2011)
Astrazeneca
Flavonoids as inhibitors of human CD38.EBI
Bioorg Med Chem Lett 21: 3939-42 (2011)
University Of Strasburg
Discovery of PH-797804, a highly selective and potent inhibitor of p38 MAP kinase.EBI
Bioorg Med Chem Lett 21: 4066-71 (2011)
Pfizer
A discovery of novel Mycobacterium tuberculosis pantothenate synthetase inhibitors based on the molecular mechanism of actinomycin D inhibition.EBI
Bioorg Med Chem Lett 21: 3943-6 (2011)
Chinese Academy Of Medical Sciences And Peking Union Medical College
Renin inhibitors for the treatment of hypertension: design and optimization of a novel series of tertiary alcohol-bearing piperidines.EBI
Bioorg Med Chem Lett 21: 3976-81 (2011)
Merck Frosst Centre For Therapeutic Research
New class of acetylcholinesterase inhibitors from the stem bark of Knema laurina and their structural insights.EBI
Bioorg Med Chem Lett 21: 4097-103 (2011)
University Putra Malaysia
7-Substituted pterins provide a new direction for ricin A chain inhibitors.EBI
Eur J Med Chem 46: 3608-15 (2011)
University Of Texas At Austin
Design, synthesis and activity of a potent, selective series of N-aryl pyridinone inhibitors of p38 kinase.EBI
Bioorg Med Chem Lett 21: 4059-65 (2011)
Pfizer
Discovery and optimization of sulfonyl acrylonitriles as selective, covalent inhibitors of protein phosphatase methylesterase-1.EBI
J Med Chem 54: 5229-36 (2011)
The Scripps Research Institute
Identification of a naturally occurring quinazolin-4(3H)-one firefly luciferase inhibitor.EBI
J Nat Prod 74: 1500-2 (2011)
Merlion Pharmaceuticals
The use of novel C-methylated spermidine derivatives to investigate the regulation of polyamine metabolism.EBI
J Med Chem 54: 4611-8 (2011)
University Of Eastern Finland
Pyridazine-derived ?-secretase modulators.EBI
Bioorg Med Chem Lett 21: 4016-9 (2011)
Glaxosmithkline Pharmaceuticals
Enantioselective binding of second generation pyrrolobenzoxazepinones to the catalytic ternary complex of HIV-1 RT wild-type and L100I and K103N drug resistant mutants.EBI
Bioorg Med Chem Lett 21: 3935-8 (2011)
2-Universit£
Structure-based design of thienobenzoxepin inhibitors of PI3-kinase.EBI
Bioorg Med Chem Lett 21: 4054-8 (2011)
Genentech
In vitro effects of some anabolic compounds on erythrocyte carbonic anhydrase I and II.BDB
J Enzyme Inhib Med Chem 27: 208-10 (2012)
Balikesir University
Synthesis and carbonic anhydrase inhibitory properties of novel bromophenols including natural products.BDB
J Enzyme Inhib Med Chem 27: 43-50 (2012)
Atatürk University
Discovery of (2E)-3-{2-butyl-1-[2-(diethylamino)ethyl]-1H-benzimidazol-5-yl}-N-hydroxyacrylamide (SB939), an orally active histone deacetylase inhibitor with a superior preclinical profile.EBI
J Med Chem 54: 4694-720 (2011)
S*Bio
Discovery and characterization of 6-{4-[3-(R)-2-methylpyrrolidin-1-yl)propoxy]phenyl}-2H-pyridazin-3-one (CEP-26401, irdabisant): a potent, selective histamine H3 receptor inverse agonist.EBI
J Med Chem 54: 4781-92 (2011)
Cephalon
Identification of a potent, state-dependent inhibitor of Nav1.7 with oral efficacy in the formalin model of persistent pain.EBI
J Med Chem 54: 4427-45 (2011)
Amgen
Identification of new inhibitors of protein kinase R guided by statistical modeling.EBI
Bioorg Med Chem Lett 21: 4108-14 (2011)
Weill Cornell Medical College
Methanesulfonamido-cyclohexylamine derivatives of 2,4-diaminopyrimidine as potent ALK inhibitors.EBI
Bioorg Med Chem Lett 21: 3877-80 (2011)
Cephalon
Irreversible Nek2 kinase inhibitors with cellular activity.EBI
J Med Chem 54: 4133-46 (2011)
University Of California
Block of the hERG channel by bupivacaine: Electrophysiological and modeling insights towards stereochemical optimization.EBI
Eur J Med Chem 46: 3486-98 (2011)
University Of Geneva
Structure-activity relationships of a series of analogues of the RFamide-related peptide 26RFa.EBI
J Med Chem 54: 4806-14 (2011)
University Of Rouen
Synthesis, protein kinase inhibitory potencies, and in vitro antiproliferative activities of meridianin derivatives.EBI
J Med Chem 54: 4474-89 (2011)
Clermont Universite£
Peptidomimetic inhibitors of bacterial peptide deformylase.EBI
Bioorg Med Chem Lett 21: 4032-5 (2011)
Vernalis (R&D)
Renin inhibitors for the treatment of hypertension: design and optimization of a novel series of pyridone-substituted piperidines.EBI
Bioorg Med Chem Lett 21: 3970-5 (2011)
Merck Frosst Centre For Therapeutic Research
Structure-based optimization of click-based histone deacetylase inhibitors.EBI
Eur J Med Chem 46: 3190-200 (2011)
Nankai University
Angiotensin-I-converting enzyme inhibitory peptides: Chemical feature based pharmacophore generation.EBI
Eur J Med Chem 46: 3428-33 (2011)
Zhejiang University
Synthesis and biological activity of derivatives of tetrahydroacridine as acetylcholinesterase inhibitors.BDB
Bioorg Chem 39: 138-42 (2011)
Medical University Of Lodz
Synthesis and discovery of novel hexacyclic cage compounds as inhibitors of acetylcholinesterase.EBI
Bioorg Med Chem Lett 21: 3997-4000 (2011)
Universiti Sains Malaysia
Discovery and optimization of potent and selective benzonaphthyridinone analogs as small molecule mTOR inhibitors with improved mouse microsome stability.EBI
Bioorg Med Chem Lett 21: 4036-40 (2011)
Dana-Farber Cancer Institute
Triazole-linked reduced amide isosteres: an approach for the fragment-based drug discovery of anti-Alzheimer's BACE1 inhibitors.EBI
Bioorg Med Chem Lett 21: 3992-6 (2011)
Virginia Tech
Generation of novel radiolabeled opiates through site-selective iodination.EBI
Bioorg Med Chem Lett 21: 4001-4 (2011)
Memorial Sloan-Kettering Cancer Center
8-Aryl- and alkyloxycaffeine analogues as inhibitors of monoamine oxidase.EBI
Eur J Med Chem 46: 3474-85 (2011)
North-West University
Preliminary evaluation of a 3H imidazoquinoline library as dual TLR7/TLR8 antagonists.EBI
Bioorg Med Chem 19: 3801-11 (2011)
University Of Kansas
Conformational variability of different sulfonamide inhibitors with thienyl-acetamido moieties attributes to differential binding in the active site of cytosolic human carbonic anhydrase isoforms.EBI
Bioorg Med Chem 19: 3732-8 (2011)
University Of Florida
Substituted N-aryl-6-pyrimidinones: a new class of potent, selective, and orally active p38 MAP kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 3856-60 (2011)
Pfizer
Discovery of novel xanthone derivatives as xanthine oxidase inhibitors.EBI
Bioorg Med Chem Lett 21: 4013-5 (2011)
Second Military Medical University
Recent progress in biological activities of synthesized phenothiazines.EBI
Eur J Med Chem 46: 3179-89 (2011)
The Medical University Of Silesia
Synthesis and biological evaluation of potential 5-HT(7) receptor PET radiotracers.EBI
Eur J Med Chem 46: 3455-61 (2011)
Universit£
Synthesis and biological evaluation of conformationally flexible as well as restricted dimers of monastrol and related dihydropyrimidones.EBI
Eur J Med Chem 46: 3274-81 (2011)
Indian Institute Of Chemical Technology
Selective kainate receptor (GluK1) ligands structurally based upon 1H-cyclopentapyrimidin-2,4(1H,3H)-dione: synthesis, molecular modeling, and pharmacological and biostructural characterization.EBI
J Med Chem 54: 4793-805 (2011)
University Of Copenhagen
Isoflavone dimers and other bioactive constituents from the figs of Ficus mucuso.EBI
J Nat Prod 74: 1370-8 (2011)
University Of Yaounde
Discovery of N-(1-ethylpropyl)-[3-methoxy-5-(2-methoxy-4-trifluoromethoxyphenyl)-6-methyl-pyrazin-2-yl]amine 59 (NGD 98-2): an orally active corticotropin releasing factor-1 (CRF-1) receptor antagonist.EBI
J Med Chem 54: 4187-206 (2011)
Neurogen
Synthesis and Structure-Activity Relationships of Benzothienothiazepinone Inhibitors of Protein Kinase D.EBI
ACS Med Chem Lett 2: 154-159 (2012)
University Of Pittsburgh
Synthesis, structure-affinity relationships, and molecular modeling studies of novel pyrazolo[3,4-c]quinoline derivatives as adenosine receptor antagonists.EBI
Bioorg Med Chem 19: 3757-68 (2011)
Universita' Di Firenze
Triazoles as¿-secretase modulators.EBI
Bioorg Med Chem Lett 21: 4083-7 (2011)
Merck Research Laboratories
Progress in structure based drug design for G protein-coupled receptors.EBI
J Med Chem 54: 4283-311 (2011)
Heptares Therapeutics
Leucettines, a class of potent inhibitors of cdc2-like kinases and dual specificity, tyrosine phosphorylation regulated kinases derived from the marine sponge leucettamine B: modulation of alternative pre-RNA splicing.EBI
J Med Chem 54: 4172-86 (2011)
Universite£? De Rennes 1
Design and synthesis of small molecule RhoA inhibitors: a new promising therapy for cardiovascular diseases?EBI
J Med Chem 54: 4508-22 (2011)
East China University Of Science And Technology
Structure-based design of novel boronic acid-based inhibitors of autotaxin.EBI
J Med Chem 54: 4619-26 (2011)
The Netherlands Cancer Institute
New FAAH inhibitors based on 3-carboxamido-5-aryl-isoxazole scaffold that protect against experimental colitis.EBI
Bioorg Med Chem 19: 3777-86 (2011)
University Of Lille
3-substitued indoles: one-pot synthesis and evaluation of anticancer and Src kinase inhibitory activities.EBI
Bioorg Med Chem Lett 21: 3511-4 (2011)
India Institute Of Technology And Science
Design strategies to target crystallographic waters applied to the Hsp90 molecular chaperone.EBI
Bioorg Med Chem Lett 21: 3557-62 (2011)
Pfizer
Carbonic anhydrase I and II inhibition with natural products: caffeine and piperine.BDB
J Enzyme Inhib Med Chem 27: 97-100 (2012)
Gitam University
Novel 3,5-bis(bromohydroxybenzylidene)piperidin-4-ones as coactivator-associated arginine methyltransferase 1 inhibitors: enzyme selectivity and cellular activity.EBI
J Med Chem 54: 4928-32 (2011)
The University Of Texas M.D. Anderson Cancer Center
Phospshoinositide 3-kinase (PI3K)/mammalian target of rapamycin (mTOR) dual inhibitors: discovery and structure-activity relationships of a series of quinoline and quinoxaline derivatives.EBI
J Med Chem 54: 4735-51 (2011)
Amgen
Analyzing airway inflammation with chemical biology: dissection of acidic mammalian chitinase function with a selective drug-like inhibitor.BDB
Chem Biol 18: 569-79 (2011)
University Of Edinburgh
Pyrone-based inhibitors of metalloproteinase types 2 and 3 may work as conformation-selective inhibitors.BDB
Chem Biol Drug Des 78: 191-8 (2011)
University Of California San Diego
Discovery of a 5H-benzo[4,5]cyclohepta[1,2-b]pyridin-5-one (MK-2461) inhibitor of c-Met kinase for the treatment of cancer.EBI
J Med Chem 54: 4092-108 (2011)
Merck Research Laboratories
Discovery of a macrocyclic o-aminobenzamide Hsp90 inhibitor with heterocyclic tether that shows extended biomarker activity and in vivo efficacy in a mouse xenograft model.EBI
Bioorg Med Chem Lett 21: 3627-31 (2011)
Pfizer
Potent and selective oxindole-based vasopressin 1b receptor antagonists with improved pharmacokinetic properties.EBI
Bioorg Med Chem Lett 21: 3828-31 (2011)
Abbott Laboratories
Discovery of the macrocycle 11-(2-pyrrolidin-1-yl-ethoxy)-14,19-dioxa-5,7,26-triaza-tetracyclo[19.3.1.1(2,6).1(8,12)]heptacosa-1(25),2(26),3,5,8,10,12(27),16,21,23-decaene (SB1518), a potent Janus kinase 2/fms-like tyrosine kinase-3 (JAK2/FLT3) inhibitor for the treatment of myelofibrosis and lymphEBI
J Med Chem 54: 4638-58 (2011)
S*Bio
Structure-based design of potent aromatase inhibitors by high-throughput docking.EBI
J Med Chem 54: 4006-17 (2011)
Universita` Di Modena E Reggio Emilia
Syntheses of cellotriose and cellotetraose analogues as transition state mimics for mechanistic studies of cellulases.EBI
Bioorg Med Chem 19: 3812-30 (2011)
Hirosaki University
Methyl-monofluorination of ibuprofen selectively increases its inhibitory activity toward cyclooxygenase-1 leading to enhanced analgesic activity and reduced gastric damage in vivo.EBI
Bioorg Med Chem Lett 21: 3578-82 (2011)
Shanghai Haini Pharmaceutical
Triazoloquinazolines as a novel class of phosphodiesterase 10A (PDE10A) inhibitors.EBI
Bioorg Med Chem Lett 21: 3738-42 (2011)
H. Lundbeck
Identification and optimisation of novel sulfonamide, selective vasopressin V1B receptor antagonists.EBI
Bioorg Med Chem Lett 21: 3603-7 (2011)
Msd
Tetrazine-trans-cyclooctene ligation for the rapid construction of integrinavß3 targeted PET tracer based on a cyclic RGD peptide.EBI
Bioorg Med Chem Lett 21: 5011-4 (2011)
University Of Delaware
Synthesis and structural investigation of some pyrimido[5,4-c]quinolin-4(3H)-one derivatives with a long-chain arylpiperazine moiety as potent 5-HT(1A/2A) and 5-HT(7) receptor ligands.EBI
Eur J Med Chem 46: 3348-61 (2011)
Medical University Of Lodz
Synthesis and evaluation of mansonone F derivatives as topoisomerase inhibitors.EBI
Eur J Med Chem 46: 3339-47 (2011)
Sun Yat-Sen University
Site-directed mutagenesis provides insights into the selective binding of trityl derivatives to Plasmodium falciparum dUTPase.EBI
Eur J Med Chem 46: 3309-14 (2011)
Instituto De Parasitolog£A Y Biomedicina L£Pez-Neyra
Bivalent dopamine D2 receptor ligands: synthesis and binding properties.EBI
J Med Chem 54: 4896-903 (2011)
Friedrich-Alexander University
Total synthesis and pharmacological characterization of solomonsterol A, a potent marine pregnane-X-receptor agonist endowed with anti-inflammatory activity.EBI
J Med Chem 54: 4590-9 (2011)
Universita Di Napoli Federico Ii
Profiling of a prescription drug library for potential renal drug-drug interactions mediated by the organic cation transporter 2.EBI
J Med Chem 54: 4548-58 (2011)
University Of California San Francisco
Structure-activity relationships of carboline and carbazole derivatives as a novel class of ATP-competitive kinesin spindle protein inhibitors.EBI
J Med Chem 54: 4839-46 (2011)
Kyoto University
Novel flavonoids with antiproliferative activities against breast cancer cells.EBI
J Med Chem 54: 4339-49 (2011)
University Of California Davis
Inhibitors of histone demethylases.EBI
Bioorg Med Chem 19: 3625-36 (2011)
University Of Copenhagen
Synthesis and SAR studies of novel 2-(6-aminomethylaryl-2-aryl-4-oxo-quinazolin-3(4H)-yl)acetamide vasopressin V1b receptor antagonists.EBI
Bioorg Med Chem Lett 21: 3813-7 (2011)
Msd
Design and synthesis of protein kinase Ca activators based on 'out of pocket' interactions.EBI
Bioorg Med Chem Lett 21: 3587-90 (2011)
Riken Advanced Science Institute
Synthesis and antityrosinase activities of alkyl 3,4-dihydroxybenzoates.EBI
J Agric Food Chem 59: 6645-9 (2011)
Xiamen University
Isoforms of the heteropteran Nezara viridula ecdysone receptor: protein characterisation, RH5992 insecticide binding and homology modelling.EBI
Pest Manag Sci 67: 1457-67 (2011)
Csiro Materials Science And Engineering And Csiro Food And Nutritional Sciences
Glucosides with cyclic diarylpolynoid as novel C-aryl glucoside SGLT2 inhibitors.EBI
Bioorg Med Chem Lett 21: 3759-63 (2011)
Green Cross
Switching between agonists and antagonists at CRTh2 in a series of highly potent and selective biaryl phenoxyacetic acids.EBI
Bioorg Med Chem Lett 21: 3616-21 (2011)
Astrazeneca R&D Charnwood
Synthesis and biological evaluation of desmethylveramiline, a micromolar Hedgehog inhibitor.EBI
Bioorg Med Chem Lett 21: 3608-12 (2011)
University Of Strasburg
Identification of N-propylnoraporphin-11-yl 5-(1,2-dithiolan-3-yl)pentanoate as a new anti-Parkinson's agent possessing a dopamine D2 and serotonin 5-HT1A dual-agonist profile.EBI
J Med Chem 54: 4324-38 (2011)
Soochow University College Of Pharmaceutical Sciences
Development ofß-amino alcohol derivatives that inhibit Toll-like receptor 4 mediated inflammatory response as potential antiseptics.EBI
J Med Chem 54: 4659-69 (2011)
University Of Colorado At Boulder
Discovery and biological evaluation of a novel class of dual microsomal prostaglandin E2 synthase-1/5-lipoxygenase inhibitors based on 2-[(4,6-diphenethoxypyrimidin-2-yl)thio]hexanoic acid.EBI
J Med Chem 54: 4490-507 (2011)
Zafes/Liff/Goethe University Frankfurt
Fenretinide derivatives act as disrupters of interactions of serum retinol binding protein (sRBP) with transthyretin and the sRBP receptor.EBI
J Med Chem 54: 4378-87 (2011)
National University Of Ireland
Exploration of acridine scaffold as a potentially interesting scaffold for discovering novel multi-target VEGFR-2 and Src kinase inhibitors.EBI
Bioorg Med Chem 19: 3312-9 (2011)
Tsinghua University
Identification of 4H,6H-[2]benzoxepino[4,5-c][1,2]oxazoles as novel squalene synthase inhibitors.EBI
Bioorg Med Chem Lett 21: 3648-53 (2011)
Bayer Pharma
Structure-activity relationship studies to probe the phosphoprotein binding site on the carboxy terminal domains of the breast cancer susceptibility gene 1.EBI
J Med Chem 54: 4264-8 (2011)
University Of Nebraska Medical Center
Toluidinesulfonamide hypoxia-induced factor 1 inhibitors: alleviating drug-drug interactions through use of PubChem data and comparative molecular field analysis guided synthesis.EBI
J Med Chem 54: 3982-6 (2011)
Elara Pharmaceuticals
Discovery of 3,5-Diamino-1,2,4-triazole Ureas as Potent Anaplastic Lymphoma Kinase Inhibitors.EBI
ACS Med Chem Lett 2: 379-384 (2011)
TBA
New 5-deoxyflavonoids and their inhibitory effects on protein tyrosine phosphatase 1B (PTP1B) activity.EBI
Bioorg Med Chem 19: 3378-83 (2011)
Chosun University
Elucidation of common pharmacophores from analysis of targeted metabolites transported by the multispecific drug transporter-Organic anion transporter1 (Oat1).EBI
Bioorg Med Chem 19: 3320-40 (2011)
University Of California
Discovery of a potent and selective small molecule hGPR91 antagonist.EBI
Bioorg Med Chem Lett 21: 3596-602 (2011)
Advinus Therapeutics
Evaluation of sulfatase-directed quinone methide traps for proteomics.EBI
Bioorg Med Chem 20: 622-7 (2012)
Bielefeld University
CXCR3 antagonists: quaternary ammonium salts equipped with biphenyl- and polycycloaliphatic-anchors.EBI
Bioorg Med Chem 19: 3384-93 (2011)
Vu University Amsterdam
The role of the 4''-hydroxyl on motilin agonist potency in the 9-dihydroerythromycin series.EBI
Bioorg Med Chem Lett 21: 3712-4 (2011)
Kosan Biosciences
Synthesis and SAR development of novel P2X7 receptor antagonists for the treatment of pain: part 1.EBI
Bioorg Med Chem Lett 21: 3805-8 (2011)
Merck Research Laboratories
Highly selective c-Jun N-terminal kinase (JNK) 3 inhibitors with in vitro CNS-like pharmacokinetic properties II. Central core replacement.EBI
Bioorg Med Chem Lett 21: 3726-9 (2011)
Elan Pharmaceuticals
Inhibition studies with anions and small molecules of two novel β-carbonic anhydrases from the bacterial pathogen Salmonella enterica serovar Typhimurium.EBI
Bioorg Med Chem Lett 21: 3591-5 (2011)
Universit£
Synthesis, biological activity and HPLC validation of 1,2,3,4-tetrahydroacridine derivatives as acetylcholinesterase inhibitors.EBI
Eur J Med Chem 46: 3250-7 (2011)
Medical University
Identification of 2-mercaptohexanoic acids as dual inhibitors of 5-lipoxygenase and microsomal prostaglandin E2 synthase-1.EBI
Bioorg Med Chem 19: 3394-401 (2011)
Eberhard Karls University Tuebingen
Design, synthesis, and biological evaluation of substituted hydrazone and pyrazole derivatives as selective COX-2 inhibitors: Molecular docking study.EBI
Bioorg Med Chem 19: 3416-24 (2011)
University Of Mansoura
Synthesis and biological evaluation of loxoprofen derivatives.EBI
Bioorg Med Chem 19: 3299-311 (2011)
Kumamoto University
Probes for narcotic receptor mediated phenomena. Part 42: synthesis and in vitro pharmacological characterization of the N-methyl and N-phenethyl analogues of the racemic ortho-c and para-c oxide-bridged phenylmorphans.EBI
Bioorg Med Chem 19: 3434-43 (2011)
National Institute On Drug Abuse And The National Institute On Alcohol Abuse And Alcoholism
Discovery of XEN907, a spirooxindole blocker of NaV1.7 for the treatment of pain.EBI
Bioorg Med Chem Lett 21: 3676-81 (2011)
Xenon Pharmaceuticals
Discovery, design and synthesis of the first reported potent and selective sphingosine-1-phosphate 4 (S1P4) receptor antagonists.EBI
Bioorg Med Chem Lett 21: 3632-6 (2011)
The Scripps Research Institute
Discovery of DA-1229: a potent, long acting dipeptidyl peptidase-4 inhibitor for the treatment of type 2 diabetes.EBI
Bioorg Med Chem Lett 21: 3809-12 (2011)
Dong-A Pharm.
Solid phase synthesis of tariquidar-related modulators of ABC transporters preferring breast cancer resistance protein (ABCG2).EBI
Bioorg Med Chem Lett 21: 3654-7 (2011)
Universidad Nacional De Colombia
Synthesis, activity, and structural analysis of novel ?-hydroxytropolone inhibitors of human immunodeficiency virus reverse transcriptase-associated ribonuclease H.EBI
J Med Chem 54: 4462-73 (2011)
National Cancer Institute-Frederick
Discovery and characterization of small molecule inhibitors of the BET family bromodomains.EBI
J Med Chem 54: 3827-38 (2011)
Glaxosmithkline
Synthesis of a novel series of tricyclic dihydrofuran derivatives: discovery of 8,9-dihydrofuro[3,2-c]pyrazolo[1,5-a]pyridines as melatonin receptor (MT1/MT2) ligands.EBI
J Med Chem 54: 4207-18 (2011)
Takeda Pharmaceutical
Virtual screening for potential inhibitors of homology modeled Leptospira interrogans MurD ligase.BDB
J Chem Biol 3: 175-87 (2010)
Svims University
Structure-based lead identification of ATP-competitive MK2 inhibitors.EBI
Bioorg Med Chem Lett 21: 3818-22 (2011)
Merck Research Laboratories
Optimization of the physicochemical and pharmacokinetic attributes in a 6-azauracil series of P2X7 receptor antagonists leading to the discovery of the clinical candidate CE-224,535.EBI
Bioorg Med Chem Lett 21: 3708-11 (2011)
Pfizer
Discovery of selective and orally available spiro-3-piperidyl ATP-competitive MK2 inhibitors.EBI
Bioorg Med Chem Lett 21: 3823-7 (2011)
Merck Research Laboratories
Optimization of triazoles as novel and potent nonphlorizin SGLT2 inhibitors.EBI
Bioorg Med Chem Lett 21: 3774-9 (2011)
Amgen
N-benzoylated phenoxazines and phenothiazines: synthesis, antiproliferative activity, and inhibition of tubulin polymerization.EBI
J Med Chem 54: 4247-63 (2011)
Westphalian Wilhelms-University
Tyrosinase inhibitory activity of a 6-isoprenoid-substituted flavanone isolated from Dalea elegans.EBI
Bioorg Med Chem 19: 3474-82 (2011)
Catholic University Of C£Rdoba
Discovery of novel tetracyclic compounds as anaplastic lymphoma kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 3788-93 (2011)
Chugai Pharmaceutical
High affinity sialoside ligands of myelin associated glycoprotein.EBI
Bioorg Med Chem Lett 21: 5045-9 (2011)
The Scripps Research Institute
Identification and synthesis of N'-(2-oxoindolin-3-ylidene)hydrazide derivatives against c-Met kinase.EBI
Bioorg Med Chem Lett 21: 3749-54 (2011)
Chinese Academy Of Sciences
Discovery of 5-(arenethynyl) hetero-monocyclic derivatives as potent inhibitors of BCR-ABL including the T315I gatekeeper mutant.EBI
Bioorg Med Chem Lett 21: 3743-8 (2011)
Ariad Pharmaceuticals
Inhibition of 1-deoxy-D-xylulose-5-phosphate reductoisomerase by lipophilic phosphonates: SAR, QSAR, and crystallographic studies.EBI
J Med Chem 54: 4721-34 (2011)
Baylor College Of Medicine
Synthesis and evaluation of diarylthiazole derivatives that inhibit activation of sterol regulatory element-binding proteins.EBI
J Med Chem 54: 4923-7 (2011)
Kyoto University
Selective inhibition of the tumor marker aldo-keto reductase family member 1B10 by oleanolic acid.EBI
J Nat Prod 74: 1201-6 (2011)
Gifu Pharmaceutical University
Discovery of a series of imidazo[4,5-b]pyridines with dual activity at angiotensin II type 1 receptor and peroxisome proliferator-activated receptor-¿.EBI
J Med Chem 54: 4219-33 (2011)
Pfizer
Quinoline-4-methyl esters as human nonpancreatic secretory phospholipase A2 inhibitors.EBI
Bioorg Med Chem 19: 3361-6 (2011)
Peking University
Molecular hybridization of 4-azahexacyclo[5.4.1.0(2,6).0(3,10).0(5,9).0(8,11)]dodecane-3-ol with sigma (s) receptor ligands modulates off-target activity and subtype selectivity.EBI
Bioorg Med Chem Lett 21: 3622-6 (2011)
The University Of Sydney
Design, synthesis, and evaluation of bromo-retrochalcone derivatives as protein tyrosine phosphatase 1B inhibitors.EBI
Bioorg Med Chem Lett 21: 3755-8 (2011)
Chonnam National University
Design, synthesis, biological evaluation and X-ray crystal structure of novel classical 6,5,6-tricyclic benzo[4,5]thieno[2,3-d]pyrimidines as dual thymidylate synthase and dihydrofolate reductase inhibitors.EBI
Bioorg Med Chem 19: 3585-94 (2011)
Duquesne University
1-Heteroaryl-6-(3,4-dichlorophenyl)-3-azabicyclo[4.1.0]heptane: further insights into a class of triple re-uptake inhibitors.EBI
Bioorg Med Chem 19: 3451-61 (2011)
Glaxosmithkline
New 2-thioether-substituted apomorphines as potent and selective dopamine D2 receptor agonists.EBI
Eur J Med Chem 46: 2992-9 (2011)
University Of Tartu
From benzimidazole to indole-5-carboxamide Thumb Pocket I inhibitors of HCV NS5B polymerase. Part 1: indole C-2 SAR and discovery of diamide derivatives with nanomolar potency in cell-based subgenomic replicons.EBI
Bioorg Med Chem Lett 21: 3658-63 (2011)
Boehringer Ingelheim (Canada)
Orally active aminopyridines as inhibitors of tetrameric fructose-1,6-bisphosphatase.EBI
Bioorg Med Chem Lett 21: 3237-42 (2011)
F. Hoffmann-La Roche
Synthesis and crystallographic analysis of new sulfonamides incorporating NO-donating moieties with potent antiglaucoma action.EBI
Bioorg Med Chem Lett 21: 3216-21 (2011)
U.O. Oculistica Az. Usl 3
Toward self-adjuvanting subunit vaccines: model peptide and protein antigens incorporating covalently bound toll-like receptor-7 agonistic imidazoquinolines.EBI
Bioorg Med Chem Lett 21: 3232-6 (2011)
University Of Kansas
Discovery of LASSBio-772, a 1,3-benzodioxole N-phenylpiperazine derivative with potent alpha 1A/D-adrenergic receptor blocking properties.EBI
Eur J Med Chem 46: 3000-12 (2011)
Universidade Federal Do Rio De Janeiro
Design, synthesis, docking, and biological evaluation of novel diazide-containing isoxazole- and pyrazole-based histone deacetylase probes.EBI
J Med Chem 54: 4350-64 (2011)
University Of Illinois At Chicago
Hippolides A-H, acyclic manoalide derivatives from the marine sponge Hippospongia lachne.EBI
J Nat Prod 74: 1248-54 (2011)
Second Military Medical University
Docking and SAR studies of D- and L-isofagomine isomers as humanß-glucocerebrosidase inhibitors.EBI
Bioorg Med Chem 19: 3558-68 (2011)
University Of Toyama
Potent mGluR5 antagonists: pyridyl and thiazolyl-ethynyl-3,5-disubstituted-phenyl series.EBI
Bioorg Med Chem Lett 21: 3243-7 (2011)
Institute For Neurodegenerative Disorders
Mycobacterium tuberculosis and cholinesterase inhibitors from Voacanga globosa.EBI
Eur J Med Chem 46: 3118-23 (2011)
University Of Santo Tomas
Discovery and characterization of a nonphosphorylated cyclic peptide inhibitor of the peptidylprolyl isomerase, Pin1.EBI
J Med Chem 54: 3854-65 (2011)
The University Of Western Ontario
Design and synthesis of 5,6-fused heterocyclic amides as Raf kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 3286-9 (2011)
Novartis Institutes For Biomedical Research
Discovery of dual target inhibitors against cyclooxygenases and leukotriene A4 hydrolyase.EBI
J Med Chem 54: 3650-60 (2011)
Peking University
Inverse virtual screening of antitumor targets: pilot study on a small database of natural bioactive compounds.EBI
J Nat Prod 74: 1401-7 (2011)
Universita Di Salerno
Novel 4,4-disubstituted piperidine-based C-C chemokine receptor-5 inhibitors with high potency against human immunodeficiency virus-1 and an improved human ether-a-go-go related gene (hERG) profile.EBI
J Med Chem 54: 3756-67 (2011)
Glaxosmithkline
Potent, selective, and orally available benzoisothiazolone phosphomannose isomerase inhibitors as probes for congenital disorder of glycosylation Ia.EBI
J Med Chem 54: 3661-8 (2011)
Sanford-Burnham Medical Research Institute
Cryptocaryols A-H,a-pyrone-containing 1,3-polyols from Cryptocarya sp. implicated in stabilizing the tumor suppressor Pdcd4.EBI
J Nat Prod 74: 1015-20 (2011)
National Cancer Institute-Frederick
Identification and characterization of new inhibitors of fungal homoserine kinase.BDB
Chembiochem 12: 1179-82 (2011)
Mcmaster University
Design and evaluation of 3-aminopyrazolopyridinone kinase inhibitors inspired by the natural product indirubin.EBI
Bioorg Med Chem 19: 3569-78 (2011)
The Institute Of Cancer Research
Synthesis and characterization of selective dopamine D2 receptor ligands using aripiprazole as the lead compound.EBI
Bioorg Med Chem 19: 3502-11 (2011)
Washington University
Discovery of a nortropanol derivative as a potent and orally active GPR119 agonist for type 2 diabetes.EBI
Bioorg Med Chem Lett 21: 3290-6 (2011)
Merck Research Laboratories
Orally active achiral N-hydroxyformamide inhibitors of ADAM-TS4 (aggrecanase-1) and ADAM-TS5 (aggrecanase-2) for the treatment of osteoarthritis.EBI
Bioorg Med Chem Lett 21: 3301-6 (2011)
Astrazeneca
Synthesis and in vitro activity of N-benzyl-1-(2,3-dichlorophenyl)-1H-tetrazol-5-amine P2X(7) antagonists.EBI
Bioorg Med Chem Lett 21: 3297-300 (2011)
Abbott Laboratories
Non-oxime pyrazole based inhibitors of B-Raf kinase.EBI
Bioorg Med Chem Lett 21: 3488-92 (2011)
Array Biopharma
Evaluation of in vitro effects of some analgesic drugs on erythrocyte and recombinant carbonic anhydrase I and II.BDB
J Enzyme Inhib Med Chem 27: 37-42 (2012)
Balikesir University
Design, synthesis, and biological activities of closantel analogues: structural promiscuity and its impact on Onchocerca volvulus.EBI
J Med Chem 54: 3963-72 (2011)
The Skaggs Institute For Chemical Biology
Inhibition of Myosin ATPase activity by halogenated pseudilins: a structure-activity study.EBI
J Med Chem 54: 3675-85 (2011)
Hannover Medical School
Identification of plasmepsin inhibitors as selective anti-malarial agents using ligand based drug design.EBI
Bioorg Med Chem Lett 21: 3335-41 (2011)
Trinity College
Synthesis and biological evaluation of 3-alkyl-dihydrotetrabenazine derivatives as vesicular monoamine transporter-2 (VMAT2) ligands.EBI
Bioorg Med Chem Lett 21: 3435-8 (2011)
University Of Pennsylvania
Design, synthesis and pharmacological evaluation of spirocyclics(1) receptor ligands with exocyclic amino moiety (increased distance 1).EBI
Bioorg Med Chem 19: 3141-51 (2011)
Institut F£R Pharmazeutische Und Medizinische Chemie Der Universit£T M£Nster
Efficacy switching SAR of mGluR5 allosteric modulators: highly potent positive and negative modulators from one chemotype.EBI
Bioorg Med Chem Lett 21: 3407-10 (2011)
H. Lundbeck
Naphthol derivatives as TRPV1 inhibitors for the treatment of urinary incontinence.EBI
Bioorg Med Chem Lett 21: 3354-7 (2011)
Bayer Yakuhin
Identification of 5-arylidene-4-thiazolidinone derivatives endowed with dual activity as aldose reductase inhibitors and antioxidant agents for the treatment of diabetic complications.EBI
Eur J Med Chem 46: 2797-806 (2011)
Universit£
Design, synthesis and inhibition activity of a novel cyclic enediyne amino acid conjugates against MPtpA.EBI
Bioorg Med Chem 19: 3274-9 (2011)
India Institute Of Technology And Science
Molecular docking studies and in vitro screening of new dihydropyridine derivatives as human MRP1 inhibitors.EBI
Bioorg Med Chem 19: 3249-54 (2011)
Kakatiya University
Structure-based design, synthesis, and nonalcoholic steatohepatitis (NASH)-preventive effect of phenylpropanoic acid peroxisome proliferator-activated receptor (PPAR)a-selective agonists.EBI
Bioorg Med Chem 19: 3183-91 (2011)
Okayama University
Phosphodiesterase inhibitors. Part 1: Synthesis and structure-activity relationships of pyrazolopyridine-pyridazinone PDE inhibitors developed from ibudilast.EBI
Bioorg Med Chem Lett 21: 3307-12 (2011)
Heriot-Watt University
Pyrimidine nucleotides with 4-alkyloxyimino and terminal tetraphosphated-ester modifications as selective agonists of the P2Y(4) receptor.EBI
J Med Chem 54: 4018-33 (2011)
Niddk
Two-step synthesis of novel, bioactive derivatives of the ubiquitous cofactor nicotinamide adenine dinucleotide (NAD).EBI
J Med Chem 54: 3492-9 (2011)
University Of East Anglia
Adenosine-derived inhibitors of 78 kDa glucose regulated protein (Grp78) ATPase: insights into isoform selectivity.BDB
J Med Chem 54: 4034-41 (2011)
Vernalis (R&D)
Synthesis and evaluation of carbaborane derivatives of indomethacin as cyclooxygenase inhibitors.EBI
Bioorg Med Chem 19: 3242-8 (2011)
Universit£T Leipzig
Discovery of novel quaternary ammonium derivatives of (3R)-quinuclidinyl carbamates as potent and long acting muscarinic antagonists.EBI
Bioorg Med Chem Lett 21: 3457-61 (2011)
RhôNe-Poulenc Rorer
2,6-Disubstituted pyrazines and related analogs as NR2B site antagonists of the NMDA receptor with anti-depressant activity.EBI
Bioorg Med Chem Lett 21: 3399-403 (2011)
Astrazeneca Pharmaceuticals
Dual IGF-1R/SRC inhibitors based on a N'-aroyl-2-(1H-indol-3-yl)-2-oxoacetohydrazide structure.EBI
Eur J Med Chem 46: 2759-69 (2011)
Technische Universit£T Braunschweig
Design, synthesis and pharmacological evaluation of conformationally restricted N-arylsulfonyl-3-aminoalkoxy indoles as a potential 5-HT6 receptor ligands.BDB
J Enzyme Inhib Med Chem 26: 341-9 (2011)
Suven Life Sciences
Nobilamides A-H, long-acting transient receptor potential vanilloid-1 (TRPV1) antagonists from mollusk-associated bacteria.EBI
J Med Chem 54: 3746-55 (2011)
University Of Utah
Design, synthesis, radiolabeling, and in vitro and in vivo evaluation of bridgehead iodinated analogues of N-{2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl}-N-(pyridin-2-yl)cyclohexanecarboxamide (WAY-100635) as potential SPECT ligands for the 5-HT1A receptor.EBI
J Med Chem 54: 3480-91 (2011)
Vu University Medical Center
Acenaphtho[1,2-b]pyrrole-based selective fibroblast growth factor receptors 1 (FGFR1) inhibitors: design, synthesis, and biological activity.EBI
J Med Chem 54: 3732-45 (2011)
East China University Of Science And Technology
Lead optimization of aryl and aralkyl amine-based triazolopyrimidine inhibitors of Plasmodium falciparum dihydroorotate dehydrogenase with antimalarial activity in mice.EBI
J Med Chem 54: 3935-49 (2011)
University Of Washington
Biological evaluation of novel benzisoxazole derivatives as PPARd agonists.EBI
Bioorg Med Chem 19: 3255-64 (2011)
Nippon Chemiphar
Virtual screening and further development of novel ALK inhibitors.EBI
Bioorg Med Chem 19: 3086-95 (2011)
Pharmadesign
Sulfonamides incorporating 1,3,5-triazine moieties selectively and potently inhibit carbonic anhydrase transmembrane isoforms IX, XII and XIV over cytosolic isoforms I and II: Solution and X-ray crystallographic studies.EBI
Bioorg Med Chem 19: 3105-19 (2011)
Universit£
Design of small molecule inhibitors of acetyl-CoA carboxylase 1 and 2 showing reduction of hepatic malonyl-CoA levels in vivo in obese Zucker rats.EBI
Bioorg Med Chem 19: 3039-53 (2011)
Astrazeneca Research And Development
Synthesis and evaluation of heteroarylalanine diacids as potent and selective neutral endopeptidase inhibitors.EBI
Bioorg Med Chem Lett 21: 3404-6 (2011)
Pfizer
New indole amide derivatives as potent CRTH2 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 3471-4 (2011)
Merck Frosst
Design of a potent, soluble glucokinase activator with increased pharmacokinetic half-life.EBI
Bioorg Med Chem Lett 21: 3467-70 (2011)
Astrazeneca R&D
Macrocyclic lactams as potent Hsp90 inhibitors with excellent tumor exposure and extended biomarker activity.EBI
Bioorg Med Chem Lett 21: 3411-6 (2011)
Pfizer
3-Amino-pyrazolo[3,4-d]pyrimidines as p38a kinase inhibitors: design and development to a highly selective lead.EBI
Bioorg Med Chem Lett 21: 3452-6 (2011)
Roche Palo Alto
Synthesis and bioactivity of new Finasteride conjugate.EBI
Bioorg Med Chem Lett 21: 3439-42 (2011)
Jilin University
Novel 4-phenylpiperidine-2,6-dione derivatives. Ligands fora1-adrenoceptor subtypes.EBI
Eur J Med Chem 46: 2676-90 (2011)
Universit£
Peroxisome proliferator-activated receptor agonists with phenethylphenylphthalimide skeleton derived from thalidomide-related liver X receptor antagonists: relationship between absolute configuration and subtype selectivity.EBI
Bioorg Med Chem 19: 3156-72 (2011)
The University Of Tokyo
Asymmetric synthesis and biological evaluations of (+)- and (-)-6-dimethoxymethyl-1,4-dihydropyridine-3-carboxylic acid derivatives blocking N-type calcium channels.EBI
Bioorg Med Chem Lett 21: 3317-9 (2011)
Ajinomoto Pharmaceuticals
3-Oxo-2-piperazinyl acetamides as potent bradykinin B1 receptor antagonists for the treatment of pain and inflammation.EBI
Bioorg Med Chem Lett 21: 3384-9 (2011)
Amgen
3-Substituted 3-(4-aryloxyaryl)-propanoic acids as GPR40 agonists.EBI
Bioorg Med Chem Lett 21: 3390-4 (2011)
Merck Research Laboratories
Synthesis, biological evaluation, and docking studies of gigantol analogs as calmodulin inhibitors.EBI
Eur J Med Chem 46: 2699-708 (2011)
Universidad Nacional Aut£Noma De M£Xico
Synthesis and biological evaluation in U87MG glioma cells of (ethynylthiophene)sulfonamido-based hydroxamates as matrix metalloproteinase inhibitors.EBI
Eur J Med Chem 46: 2617-29 (2011)
Universit£
New halogenated phenylcoumarins as tyrosinase inhibitors.EBI
Bioorg Med Chem Lett 21: 3342-5 (2011)
Universidad De Santiago De Compostela
Structure-activity relationship studies of novel 3-oxazolidinedione-6-naphthyl-2-pyridinones as potent and orally bioavailable EP3 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 2806-11 (2011)
Glaxosmithkline
Thiazolylmethyl ortho-substituted phenyl glucoside library as novel C-aryl glucoside SGLT2 inhibitors.EBI
Eur J Med Chem 46: 2662-75 (2011)
Green Cross Corporation Research Center
Sequential mechanism of assembly of multidrug efflux pump AcrAB-TolC.BDB
Chem Biol 18: 454-63 (2011)
University Of Oklahoma
Resorcylic acid lactones with cytotoxic and NF-¿B inhibitory activities and their structure-activity relationships.EBI
J Nat Prod 74: 1126-31 (2011)
University Of North Carolina At Greensboro
Cannabinoid type 1 receptor antagonists modulate transport activity of multidrug resistance-associated proteins MRP1, MRP2, MRP3, and MRP4.EBI
Drug Metab Dispos 39: 1294-302 (2011)
Radboud University Nijmegen Medical Centre
Inhibition and structural reliability of prenylated flavones from the stem bark of Morus lhou on β-secretase (BACE-1).EBI
Bioorg Med Chem Lett 21: 2945-8 (2011)
Gyeongsang National University
Pharmacophore elucidation for a new series of 2-aryl-pyrazolo-triazolo-pyrimidines as potent human A3 adenosine receptor antagonists.EBI
Bioorg Med Chem Lett 21: 2898-905 (2011)
National University Of Singapore
Azaphilones and p-terphenyls from the mangrove endophytic fungus Penicillium chermesinum (ZH4-E2) isolated from the South China Sea.EBI
J Nat Prod 74: 997-1002 (2011)
Sun Yat-Sen University
Estrogenic activity of chemical constituents from Tephrosia candida.EBI
J Nat Prod 74: 937-42 (2011)
National Research Centre
Xylarenones C-E from an endophytic fungus isolated from Alibertia macrophylla.EBI
J Nat Prod 74: 1353-7 (2011)
Universidade Estadual Paulista
Synthesis and SAR of pyrimidine-based, non-nucleotide P2Y14 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 2832-5 (2011)
Merck Frosst Center For Therapeutic Research
The identification of 4,7-disubstituted naphthoic acid derivatives as UDP-competitive antagonists of P2Y14.EBI
Bioorg Med Chem Lett 21: 2836-9 (2011)
Merck Frosst Centre For Therapeutic Research
MMP-13 selectivea-sulfone hydroxamates: a survey of P1' heterocyclic amide isosteres.EBI
Bioorg Med Chem Lett 21: 2820-2 (2011)
Pfizer
A novel series of piperazinyl-pyridine ureas as antagonists of the purinergic P2Y12 receptor.EBI
Bioorg Med Chem Lett 21: 2877-81 (2011)
Astrazeneca R&D
The discovery of novel benzofuran-2-carboxylic acids as potent Pim-1 inhibitors.EBI
Bioorg Med Chem Lett 21: 3050-6 (2011)
Genzyme
HCV-NS3/4A protease inhibitory iridoid glucosides and dimeric foliamenthoic acid derivatives from Anarrhinum orientale.EBI
J Nat Prod 74: 943-8 (2011)
Cairo University
Unexpected binding orientation of bulky-B-ring anti-androgens and implications for future drug targets.EBI
J Med Chem 54: 3973-6 (2011)
The University Of Tennessee
Anticonvulsant 4-aminobenzenesulfonamide derivatives with branched-alkylamide moieties: X-ray crystallography and inhibition studies of human carbonic anhydrase isoforms I, II, VII, and XIV.EBI
J Med Chem 54: 3977-81 (2011)
The Hebrew University Of Jerusalem
Discovery of orally active, potent, and selective benzotriazole-based PTP1B inhibitors.BDB
ChemMedChem 6: 1011-6 (2011)
Zydus Research Centre
Crystal structure of the Ca2+/calmodulin-dependent protein kinase kinase in complex with the inhibitor STO-609.BDB
J Biol Chem 286: 22570-9 (2011)
Riken Systems And Structural Biology Center
Synthesis and biological evaluation of novel quinazoline-derived human Pin1 inhibitors.EBI
Bioorg Med Chem 19: 2797-807 (2011)
Chinese Academy Of Medical Sciences & Peking Union Medical College
Synthesis of cinnamoyl ketoamides as hybrid structures of antioxidants and calpain inhibitors.EBI
Bioorg Med Chem Lett 21: 2850-4 (2011)
College Of Pharmacy Kyung Hee University
Carnitine palmitoyltransferase (CPT) modulators: a medicinal chemistry perspective on 35 years of research.EBI
J Med Chem 54: 3109-52 (2011)
F. Hoffmann-La Roche
Inhibition of the Hematopoietic Protein Tyrosine Phosphatase by Phenoxyacetic Acids.EBI
ACS Med Chem Lett 2: 113-118 (2011)
Sanford-Burnham Medical Research Institute
Switching reversibility to irreversibility in glycogen synthase kinase 3 inhibitors: clues for specific design of new compounds.EBI
J Med Chem 54: 4042-56 (2011)
Instituto De Qui£?Mica Medica-Csic
Gusanlungionosides A-D, potential tyrosinase inhibitors from Arcangelisia gusanlung.EBI
J Nat Prod 74: 1009-14 (2011)
Institute Of Medicinal Plant Development
N-3 Hydroxylation of Pyrimidine-2,4-diones Yields Dual Inhibitors of HIV Reverse Transcriptase and Integrase.EBI
ACS Med Chem Lett 2: 63-67 (2011)
University Of Minnesota
N-Alkenyl and cycloalkyl carbamates as dual acting histamine H3 and H4 receptor ligands.EBI
Bioorg Med Chem 19: 2850-8 (2011)
Jagiellonian University Medical College
Development and SAR of functionally selective allosteric modulators of GABAA receptors.EBI
Bioorg Med Chem 19: 2927-38 (2011)
Astrazeneca
Synthesis and evaluation of heterobivalent tacrine derivatives as potential multi-functional anti-Alzheimer agents.EBI
Eur J Med Chem 46: 2609-16 (2011)
Sun Yat-Sen University
Potential virtual lead identification in the discovery of renin inhibitors: application of ligand and structure-based pharmacophore modeling approaches.EBI
Eur J Med Chem 46: 2469-76 (2011)
Gyeongsang National University (Gnu)
Lead optimization of 4-imidazolylflavans: new promising aromatase inhibitors.EBI
Eur J Med Chem 46: 2541-5 (2011)
Upres Ea 4021 Biomol�Cules Et Th�Rapies Anti-Tumorales
Development of amidine-based sphingosine kinase 1 nanomolar inhibitors and reduction of sphingosine 1-phosphate in human leukemia cells.EBI
J Med Chem 54: 3524-48 (2011)
University Of Virginia
N-(3-fluoro-4-(4-(2-methoxy or 2,3-dichlorophenyl)piperazine-1-yl)butyl)arylcarboxamides as selective dopamine D3 receptor ligands: critical role of the carboxamide linker for D3 receptor selectivity.EBI
J Med Chem 54: 3581-94 (2011)
National Institute On Drug Abuse-Intramural Research Program
Potent, selective, and orally bioavailable inhibitors of mammalian target of rapamycin (mTOR) kinase based on a quaternary substituted dihydrofuropyrimidine.EBI
J Med Chem 54: 3426-35 (2011)
Genentech
Red-fluorescent argininamide-type NPY Y1 receptor antagonists as pharmacological tools.EBI
Bioorg Med Chem 19: 2859-78 (2011)
Universit£T Regensburg
Structural requirements of flavonoids for the adipogenesis of 3T3-L1 cells.EBI
Bioorg Med Chem 19: 2835-41 (2011)
Kyoto Pharmaceutical University
In vitro and in vivo evaluation of 6-aminopyrazolyl-pyridine-3-carbonitriles as JAK2 kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 2958-61 (2011)
Astrazeneca R&D Boston
Development of tricyclic hydroxy-1H-pyrrolopyridine-trione containing HIV-1 integrase inhibitors.EBI
Bioorg Med Chem Lett 21: 2986-90 (2011)
National Cancer Institute-Frederick
Synthesis and evaluation of dual site inhibitors of 3-deoxy-D-arabino-heptulosonate 7-phosphate synthase.EBI
Bioorg Med Chem Lett 21: 5092-7 (2011)
University Of Canterbury
Discovery of pyrimidine carboxamides as potent and selective CCK1 receptor agonists.EBI
Bioorg Med Chem Lett 21: 2911-5 (2011)
Merck
MMP-13 selective alpha-sulfone hydroxamates: identification of selective P1' amides.EBI
Bioorg Med Chem Lett 21: 2823-5 (2011)
Pfizer
Inhibitor selectivity of a new class of oseltamivir analogs against viral neuraminidase over human neuraminidase enzymes.EBI
Bioorg Med Chem 19: 2817-22 (2011)
University Of Alberta
New monoterpene glycosides and phenolic compounds from Distylium racemosum and their inhibitory activity against ribonuclease H.EBI
Bioorg Med Chem Lett 21: 2840-4 (2011)
Chungnam National University
Discovery of piperidinyl aminopyrimidine derivatives as IKK-2 inhibitors.EBI
Bioorg Med Chem Lett 21: 3002-6 (2011)
Korea Institute Of Science And Technology
Aromatic phosphonates inhibit the lysophospholipase D activity of autotaxin.EBI
Bioorg Med Chem Lett 21: 5098-101 (2011)
The University Of Utah
SAR studies of pyridazinone derivatives as novel glucan synthase inhibitors.EBI
Bioorg Med Chem Lett 21: 2890-3 (2011)
Merck Research Laboratories
SHAFTS: a hybrid approach for 3D molecular similarity calculation. 2. Prospective case study in the discovery of diverse p90 ribosomal S6 protein kinase 2 inhibitors to suppress cell migration.EBI
J Med Chem 54: 3564-74 (2011)
East China University Of Science And Technology
Design and synthesis of N-phenylacetyl (sulfonyl) 4,5-dihydropyrazole derivatives as potential antitumor agents.EBI
Bioorg Med Chem Lett 21: 2916-20 (2011)
Nanjing University
Cyclic lactam hybrida-MSH/Agouti-related protein (AGRP) analogues with nanomolar range binding affinities at the human melanocortin receptors.EBI
Bioorg Med Chem Lett 21: 3099-102 (2011)
University Of Arizona
Discovery of small molecule human FPR1 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 2991-7 (2011)
Astrazeneca
Potent and selective phosphopeptide mimetic prodrugs targeted to the Src homology 2 (SH2) domain of signal transducer and activator of transcription 3.EBI
J Med Chem 54: 3549-63 (2011)
University Of Texas M. D. Anderson Cancer Center
Discovery of 1-[2-(2,4-dimethylphenylsulfanyl)phenyl]piperazine (Lu AA21004): a novel multimodal compound for the treatment of major depressive disorder.EBI
J Med Chem 54: 3206-21 (2011)
H. Lundbeck
Gambogic acid, a natural product inhibitor of Hsp90.EBI
J Nat Prod 74: 1085-92 (2011)
Oklahoma State University
Comparative CYP1A1 and CYP1B1 substrate and inhibitor profile of dietary flavonoids.EBI
Bioorg Med Chem 19: 2842-9 (2011)
University Of Crete
Synthesis and binding affinity of novel mono- and bivalent morphinan ligands for κ, μ, and δ opioid receptors.EBI
Bioorg Med Chem 19: 2808-16 (2011)
Harvard Medical School
Heteroalicyclic carboxamidines as inhibitors of inducible nitric oxide synthase; the identification of (2R)-2-pyrrolidinecarboxamidine as a potent and selective haem-co-ordinating inhibitor.EBI
Bioorg Med Chem Lett 21: 3037-40 (2011)
Glaxosmithkline
Discovery of new nanomolar peroxisome proliferator-activated receptor κ activators via elaborate ligand-based modeling.EBI
Eur J Med Chem 46: 2513-29 (2011)
Universiti Sains Malaysia
HIF-1a inhibitors: synthesis and biological evaluation of novel moracin O and P analogues.EBI
Eur J Med Chem 46: 2386-96 (2011)
Dongguk University-Seoul
Synthesis of 7,9-diazabicyclo[4.2.2]decanes as conformationally restricted κ receptor agonists: fine tuning of the dihedral angle of the ethylenediamine pharmacophore.EBI
Eur J Med Chem 46: 1972-82 (2011)
Institut F£R Pharmazeutische Und Medizinische Chemie Der Universit£T M£Nster
Synthesis and biological evaluation of novel 4-benzylpiperazine ligands for sigma-1 receptor imaging.EBI
Bioorg Med Chem 19: 2911-7 (2011)
Key Laboratory Of Radiopharmaceuticals (Beijing Normal University)
New aromatic substituted pyrazoles as selective inhibitors of human adipocyte fatty acid-binding protein.EBI
Bioorg Med Chem Lett 21: 2949-52 (2011)
Chinese Academy Of Sciences
Selective and potent agonists for estrogen receptor beta derived from molecular refinements of salicylaldoximes.EBI
Eur J Med Chem 46: 2453-62 (2011)
Universit£
Synthesis and biological evaluation of 2,4,5-substituted pyrimidines as a new class of tubulin polymerization inhibitors.EBI
J Med Chem 54: 3200-5 (2011)
Chinese Academy Of Sciences
Aromatic radiofluorination and biological evaluation of 2-aryl-6-[18F]fluorobenzothiazoles as a potential positron emission tomography imaging probe for ?-amyloid plaques.EBI
Bioorg Med Chem 19: 2980-90 (2011)
Seoul National University Bundang Hospital
Non-competitive and selective dipeptidyl peptidase IV inhibitors with phenethylphenylphthalimide skeleton derived from thalidomide-relateda-glucosidase inhibitors and liver X receptor antagonists.EBI
Bioorg Med Chem Lett 21: 3041-5 (2011)
The University Of Tokyo
Development of tetrahydroisoquinoline-based hydroxamic acid derivatives: potent histone deacetylase inhibitors with marked in vitro and in vivo antitumor activities.EBI
J Med Chem 54: 2823-38 (2011)
Shandong University
Neonicotinoid insecticides: oxidative stress in planta and metallo-oxidase inhibition.EBI
J Agric Food Chem 59: 4860-7 (2011)
University Of California
Potent macrocyclic inhibitors of insulin-regulated aminopeptidase (IRAP) by olefin ring-closing metathesis.EBI
J Med Chem 54: 3779-92 (2011)
Uppsala University
Novel potent and selectives ligands: evaluation of their agonist and antagonist properties.EBI
J Med Chem 54: 3669-73 (2011)
University Of Catania
Identification of chemicals to inhibit the kinase activity of leucine-rich repeat kinase 2 (LRRK2), a Parkinson's disease-associated protein.EBI
Bioorg Med Chem Lett 21: 2953-7 (2011)
Inje University
1,6-Dihydro-2H-indeno[5,4-b]furan derivatives: design, synthesis, and pharmacological characterization of a novel class of highly potent MT2-selective agonists.EBI
J Med Chem 54: 3436-44 (2011)
Takeda Pharmaceutical
Synthesis and structure-activity relationship of tricyclic carboxylic acids as novel anti-histamines.EBI
Bioorg Med Chem 19: 3005-21 (2011)
Dainippon Sumitomo Pharma
NMS-P937, a 4,5-dihydro-1H-pyrazolo[4,3-h]quinazoline derivative as potent and selective Polo-like kinase 1 inhibitor.EBI
Bioorg Med Chem Lett 21: 2969-74 (2011)
Nerviano Medical Sciences
Virtual screening identification of novel severe acute respiratory syndrome 3C-like protease inhibitors and in vitro confirmation.EBI
Bioorg Med Chem Lett 21: 3088-91 (2011)
Chonnam National University
Sulfonamides incorporating boroxazolidone moieties are potent inhibitors of the transmembrane, tumor-associated carbonic anhydrase isoforms IX and XII.EBI
Bioorg Med Chem Lett 21: 2975-9 (2011)
Ecole Nationale Sup£Rieure De Chimie De Montpellier
Radiosynthesis and preliminary evaluation of 4-[18F]fluoro-N-[4-[6-(isopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-N-methylbenzamide as a new positron emission tomography ligand for metabotropic glutamate receptor subtype 1.EBI
Bioorg Med Chem Lett 21: 2998-3001 (2011)
National Institute Of Radiological Sciences
Novel benzo[b]thiophene derivatives as new potential antidepressants with rapid onset of action.EBI
J Med Chem 54: 3086-90 (2011)
University Of Navarra
Synthesis and separation of the enantiomers of the neuropeptide S receptor antagonist (9R/S)-3-oxo-1,1-diphenyl-tetrahydro-oxazolo[3,4-a]pyrazine-7-carboxylic acid 4-fluoro-benzylamide (SHA 68).EBI
J Med Chem 54: 2738-44 (2011)
University Of Ferrara
Exploring the size limit of templates for inhibitors of the M2 ion channel of influenza A virus.EBI
J Med Chem 54: 2646-57 (2011)
Universitat De Barcelona
Pharmacophore modeling and virtual screening for novel acidic inhibitors of microsomal prostaglandin E2 synthase-1 (mPGES-1).EBI
J Med Chem 54: 3163-74 (2011)
University Of Innsbruck
Potent bivalent Smac mimetics: effect of the linker on binding to inhibitor of apoptosis proteins (IAPs) and anticancer activity.EBI
J Med Chem 54: 3306-18 (2011)
University Of Michigan
Extending SAR of bile acids as FXR ligands: discovery of 23-N-(carbocinnamyloxy)-3a,7a-dihydroxy-6a-ethyl-24-nor-5β-cholan-23-amine.EBI
Bioorg Med Chem 19: 2650-8 (2011)
Universit£
Synthesis and pharmacological evaluation of thieno[2,3-b]pyridine derivatives as novel c-Src inhibitors.EBI
Bioorg Med Chem 19: 2517-28 (2011)
Institut De Recherches Servier
Synthesis, modelling and kinetic assays of potent inhibitors of purple acid phosphatase.EBI
Bioorg Med Chem Lett 21: 3092-4 (2011)
The University Of Queensland
1,5-Substituted nipecotic amides: selective PDE8 inhibitors displaying diastereomer-dependent microsomal stability.EBI
Bioorg Med Chem Lett 21: 3095-8 (2011)
Pfizer
Quinolizidinyl derivatives of bi- and tricyclic systems as potent inhibitors of acetyl- and butyrylcholinesterase with potential in Alzheimer's disease.EBI
Eur J Med Chem 46: 2170-84 (2011)
Universit£
Design, synthesis, and structure-activity relationship studies of thiophene-3-carboxamide derivatives as dual inhibitors of the c-Jun N-terminal kinase.EBI
Bioorg Med Chem 19: 2582-8 (2011)
Sanford-Burnham Medical Research Institute
The discovery of novel 8-azabicyclo[3.2.1]octan-3-yl)-3-(4-chlorophenyl) propanamides as vasopressin V1A receptor antagonists.EBI
Bioorg Med Chem Lett 21: 3163-7 (2011)
Msd
Triamino pyrimidines and pyridines as histamine H(4) receptor modulators.EBI
Bioorg Med Chem Lett 21: 3113-6 (2011)
Johnson & Johnson Pharmaceutical Research & Development
Synthesis and evaluation of novel N-fluoropyridyl derivatives of tropane as potential PET imaging agents for the dopamine transporter.EBI
Bioorg Med Chem Lett 21: 2962-5 (2011)
Key Laboratory Of Radiopharmaceuticals (Beijing Normal University)
2-(2-Aminothiazol-4-yl)pyrrolidine-based tartrate diamides as potent, selective and orally bioavailable TACE inhibitors.EBI
Bioorg Med Chem Lett 21: 3172-6 (2011)
Merck Research Laboratories
Elucidation of a structural basis for the inhibitor-driven, p62 (SQSTM1)-dependent intracellular redistribution of cAMP phosphodiesterase-4A4 (PDE4A4).EBI
J Med Chem 54: 3331-47 (2011)
University Of Glasgow
Highly improved metabolic stability and pharmacokinetics of indium-111-DOTA-gastrin conjugates for targeting of the gastrin receptor.EBI
J Med Chem 54: 2602-9 (2011)
University Medical Centre Ljubljana
Structural analysis of the mechanism of inhibition and allosteric activation of the kinase domain of HER2 protein.BDB
J Biol Chem 286: 18756-65 (2011)
Takeda Pharmaceutical
Biological evaluation of 3'-O-alkylated analogs of salacinol, the role of hydrophobic alkyl group at 3' position in the side chain on thea-glucosidase inhibitory activity.EBI
Bioorg Med Chem Lett 21: 3159-62 (2011)
Kinki University
Antidiabetic activity of some pentacyclic acid triterpenoids, role of PTP-1B: in vitro, in silico, and in vivo approaches.EBI
Eur J Med Chem 46: 2243-51 (2011)
Universidad Aut£Noma Del Estado De Morelos
Synthesis, evaluation and metabolic studies of radiotracers containing a 4-(4-[18F]-fluorobenzyl)piperidin-1-yl moiety for the PET imaging of NR2B NMDA receptors.EBI
Eur J Med Chem 46: 2295-309 (2011)
I2Bm
On a possible neutral charge state for the catalytic dyad inß-secretase when bound to hydroxyethylene transition state analogue inhibitors.EBI
J Med Chem 54: 3081-5 (2011)
Universidad De Santiago De Compostela
Studies of O,O-dimethyl ?-(2,4-dichlorophenoxyacetoxy)ethylphosphonate (HW02) as a new herbicide. 1. Synthesis and herbicidal activity of HW02 and analogues as novel inhibitors of pyruvate dehydrogenase complex.EBI
J Agric Food Chem 59: 4801-13 (2011)
Central China Normal University
Revisiting glitazars: thiophene substituted oxazole containinga-ethoxy phenylpropanoic acid derivatives as highly potent PPARa/¿ dual agonists devoid of adverse effects in rodents.EBI
Bioorg Med Chem Lett 21: 3103-9 (2011)
Zydus Research Centre
Potent and selective small molecule inhibitors of specific isoforms of Cdc2-like kinases (Clk) and dual specificity tyrosine-phosphorylation-regulated kinases (Dyrk).EBI
Bioorg Med Chem Lett 21: 3152-8 (2011)
National Human Genome Research Institute
Chiral sulfoxides as metabolites of 2-thioimidazole-based p38a mitogen-activated protein kinase inhibitors: enantioselective synthesis and biological evaluation.EBI
J Med Chem 54: 3283-97 (2011)
Eberhard-Karls-University Tu£Bingen
Discovery of a clinical candidate from the structurally unique dioxa-bicyclo[3.2.1]octane class of sodium-dependent glucose cotransporter 2 inhibitors.EBI
J Med Chem 54: 2952-60 (2011)
Pfizer
Developing potent human uric acid transporter 1 (hURAT1) inhibitors.EBI
J Med Chem 54: 2701-13 (2011)
University Of Colorado Anschutz Medical Campus
Identification of 3H-naphtho[1,2,3-de]quinoline-2,7-diones as inhibitors of apoptosis signal-regulating kinase 1 (ASK1).EBI
J Med Chem 54: 2680-6 (2011)
Nas Of Ukraine
Mechanism-based inactivation of cytochrome P450 3A4 by mibefradil through heme destruction.EBI
Drug Metab Dispos 39: 1188-95 (2011)
Amgen
A novel family of insect-selective peptide neurotoxins targeting insect large-conductance calcium-activated K+ channels isolated from the venom of the theraphosid spider Eucratoscelus constrictus.EBI
Mol Pharmacol 80: 1-13 (2011)
University Of Technology Sydney
Design and synthesis of novel N-hydroxy-dihydronaphthyridinones as potent and orally bioavailable HIV-1 integrase inhibitors.EBI
J Med Chem 54: 3393-417 (2011)
Pfizer
Further structure-activity relationship studies on 4-((((3S,6S)-6-benzhydryltetrahydro-2H-pyran-3-yl)amino)methyl)phenol: identification of compounds with triple uptake inhibitory activity as potential antidepressant agents.EBI
J Med Chem 54: 2924-32 (2011)
Wayne State University
Crystal structure of tert-butyldimethylsilyl-spiroaminooxathioledioxide-thymine (TSAO-T) in complex with HIV-1 reverse transcriptase (RT) redefines the elastic limits of the non-nucleoside inhibitor-binding pocket.EBI
J Med Chem 54: 2727-37 (2011)
Rutgers University
Discovery of highly potent and neurotensin receptor 2 selective neurotensin mimetics.EBI
J Med Chem 54: 2915-23 (2011)
Friedrich-Alexander University
Discovery of fused bicyclic agonists of the orphan G-protein coupled receptor GPR119 with in vivo activity in rodent models of glucose control.EBI
Bioorg Med Chem Lett 21: 3134-41 (2011)
Arena Pharmaceuticals
Synthesis of 4-(aminoalkyl) substituted 1,3-dioxanes as potent NMDA ands receptor antagonists.EBI
Eur J Med Chem 46: 2157-69 (2011)
Westf£Lischen Wilhelms-Universit£T M£Nster
A potent and orally active antagonist (SM-406/AT-406) of multiple inhibitor of apoptosis proteins (IAPs) in clinical development for cancer treatment.EBI
J Med Chem 54: 2714-26 (2011)
University Of Michigan
Selenophene-containing inhibitors of type IIA bacterial topoisomerases.EBI
J Med Chem 54: 3418-25 (2011)
Achillion Pharmaceuticals
Design, synthesis, biological activity, and ADME properties of pyrazolo[3,4-d]pyrimidines active in hypoxic human leukemia cells: a lead optimization study.EBI
J Med Chem 54: 2610-26 (2011)
University Of Siena
Local structural changes, global data views: graphical substructure-activity relationship trailing.EBI
J Med Chem 54: 2944-51 (2011)
Rheinische Friedrich-Wilhelms-Universita£T
Utilization of nitrophenylphosphates and oxime-based ligation for the development of nanomolar affinity inhibitors of the Yersinia pestis outer protein H (YopH) phosphatase.EBI
J Med Chem 54: 2933-43 (2011)
National Cancer Institute-Frederick
Synthesis and evaluation of arylquinones as BACE1 inhibitors,β-amyloid peptide aggregation inhibitors, and destabilizers of preformed β-amyloid fibrils.EBI
Bioorg Med Chem Lett 21: 2183-7 (2011)
Universidad Complutense
Inhibitors of the tyrosine kinase EphB4. Part 4: Discovery and optimization of a benzylic alcohol series.EBI
Bioorg Med Chem Lett 21: 2207-11 (2011)
Astrazeneca
Synthesis and evaluation of isatin analogs as caspase-3 inhibitors: introduction of a hydrophilic group increases potency in a whole cell assay.EBI
Bioorg Med Chem Lett 21: 2192-7 (2011)
Washington University
Discovery of the first non-ATP competitive IGF-1R kinase inhibitors: advantages in comparison with competitive inhibitors.EBI
Bioorg Med Chem Lett 21: 2224-8 (2011)
Sanofi-Aventis
Acyl derivatives of p-aminosulfonamides and dapsone as new inhibitors of the arginine methyltransferase hPRMT1.EBI
Bioorg Med Chem 19: 3717-31 (2011)
Albert-Ludwigs-University Of Freiburg
Synthesis of 1-naphtylpiperazine derivatives as serotoninergic ligands and their evaluation as antiproliferative agents.EBI
Eur J Med Chem 46: 2206-16 (2011)
Universit£
Inhibition of the M. tuberculosis 3β-hydroxysteroid dehydrogenase by azasteroids.EBI
Bioorg Med Chem Lett 21: 2216-9 (2011)
Stony Brook University
Discovery of a piperazine urea based compound as a potent, selective, orally bioavailable melanocortin subtype-4 receptor partial agonist.EBI
Bioorg Med Chem Lett 21: 2330-4 (2011)
Merck Research Laboratories
Pyrrolidine-pyrazole ureas as potent and selective inhibitors of 11β-hydroxysteroid-dehydrogenase type 1.EBI
Bioorg Med Chem Lett 21: 2244-51 (2011)
Sanofi-Aventis R&D
Identification of pentacyclic triterpenes derivatives as potent inhibitors against glycogen phosphorylase based on 3D-QSAR studies.EBI
Eur J Med Chem 46: 2011-21 (2011)
Chinese Academy Of Sciences
Aspartic vinyl sulfones: inhibitors of a caspase-3-dependent pathway.EBI
Eur J Med Chem 46: 2141-6 (2011)
University Of Lisbon
Jak1 has a dominant role over Jak3 in signal transduction through γc-containing cytokine receptors.BDB
Chem Biol 18: 314-23 (2011)
University Of Luxembourg
Oxamic acid analogues as LDH-C4-specific competitive inhibitors.BDB
J Enzyme Inhib Med Chem 26: 579-86 (2011)
Instituto Politécnico Nacional
Amidine-oximes: reactivators for organophosphate exposure.EBI
J Med Chem 54: 3319-30 (2011)
Human Biomolecular Research Institute
Isolation and structure of homotemsirolimuses A, B, and C.EBI
J Nat Prod 74: 547-53 (2011)
Wyeth Research
Identification of inhibitors that block vaccinia virus infection by targeting the DNA synthesis processivity factor D4.EBI
J Med Chem 54: 3260-7 (2011)
University Of Pennsylvania
Optimization of potent, selective, and orally bioavailable pyrrolodinopyrimidine-containing inhibitors of heat shock protein 90. Identification of development candidate 2-amino-4-{4-chloro-2-[2-(4-fluoro-1H-pyrazol-1-yl)ethoxy]-6-methylphenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrEBI
J Med Chem 54: 3368-85 (2011)
Pfizer
Synthesis and evaluation of radioligands for imaging brain nociceptin/orphanin FQ peptide (NOP) receptors with positron emission tomography.EBI
J Med Chem 54: 2687-700 (2011)
National Institute Of Mental Health
Identification, characterization, and implications of species-dependent plasma protein binding for the oral Hedgehog pathway inhibitor vismodegib (GDC-0449).EBI
J Med Chem 54: 2592-601 (2011)
Genentech
Synthesis and biological evaluation of 1-substituted-3(5)-(6-methylpyridin-2-yl)-4-(quinolin-6-yl)pyrazoles as transforming growth factor-β type 1 receptor kinase inhibitors.EBI
Bioorg Med Chem 19: 2633-40 (2011)
Ewha Womans University
The synthesis and evaluation of indolylureas as PKCa inhibitors.EBI
Bioorg Med Chem 19: 2742-50 (2011)
Procter & Gamble Pharmaceuticals
Identification of potent, soluble, and orally active TRPV1 antagonists.EBI
Bioorg Med Chem Lett 21: 2559-63 (2011)
Msd
Aza-annulation on the 16-dehydropregnenolone, via tandem intermolecular aldol process and intramolecular Michael addition.EBI
Bioorg Med Chem Lett 21: 2232-7 (2011)
Central Drug Research Institute
New potent human acetylcholinesterase inhibitors in the tetracyclic triterpene series with inhibitory potency on amyloid β aggregation.EBI
Eur J Med Chem 46: 2193-205 (2011)
Cnrs
Synthesis and structure-activity relationship studies of urea-containing pyrazoles as dual inhibitors of cyclooxygenase-2 and soluble epoxide hydrolase.EBI
J Med Chem 54: 3037-50 (2011)
University Of California
17,20-Lyase inhibitors. Part 3: Design, synthesis, and structure-activity relationships of biphenylylmethylimidazole derivatives as novel 17,20-lyase inhibitors.EBI
Bioorg Med Chem 19: 2428-42 (2011)
Takeda Pharmaceutical
Synthesis and anti-melanogenic activity of hydroxyphenyl benzyl ether analogues.EBI
Bioorg Med Chem 19: 2168-75 (2011)
Catholic University Of Daegu
Design, synthesis and structure-activity relationship (SAR) studies of 2,4-disubstituted pyrimidine derivatives: dual activity as cholinesterase and A β-aggregation inhibitors.EBI
Bioorg Med Chem 19: 2269-81 (2011)
University Of Waterloo
Pentacycloundecane-based inhibitors of wild-type C-South African HIV-protease.EBI
Bioorg Med Chem Lett 21: 2274-7 (2011)
University Of Kwazulu-Natal
The discovery and synthesis of potent zwitterionic inhibitors of renin.EBI
Bioorg Med Chem Lett 21: 2430-6 (2011)
Merck Frosst Centre For Therapeutic Research
3,5-Disubstituted-indole-7-carboxamides: the discovery of a novel series of potent, selective inhibitors of IKK-ß.EBI
Bioorg Med Chem Lett 21: 2255-8 (2011)
Glaxosmithkline
Discovery, synthesis, and investigation of the antitumor activity of novel piperazinylpyrimidine derivatives.EBI
Eur J Med Chem 46: 2043-57 (2011)
University Of The Pacific
Small molecule inhibitors of retinoic acid 4-hydroxylase (CYP26): synthesis and biological evaluation of imidazole methyl 3-(4-(aryl-2-ylamino)phenyl)propanoates.EBI
J Med Chem 54: 2778-91 (2011)
Cardiff University
Reversible competitivea-ketoheterocycle inhibitors of fatty acid amide hydrolase containing additional conformational constraints in the acyl side chain: orally active, long-acting analgesics.EBI
J Med Chem 54: 2805-22 (2011)
The Scripps Research Institute
N-(4-cyanotetrahydro-2H-pyran-4-yl) and N-(1-cyanocyclohexyl) derivatives of 1,5-diarylpyrazole-3-carboxamides showing high affinity for 18 kDa translocator protein and/or cannabinoid receptors.EBI
J Med Chem 54: 2961-70 (2011)
National Institute Of Mental Health
Cytotoxic and NF-κB inhibitory constituents of the stems of Cratoxylum cochinchinense and their semisynthetic analogues.EBI
J Nat Prod 74: 1117-25 (2011)
The Ohio State University
Design, synthesis, and pharmacological characterization of fluorescent peptides for imaging human V1b vasopressin or oxytocin receptors.EBI
J Med Chem 54: 2864-77 (2011)
University Of Montpellier
Exploration of the activity of 7-pyrrolidino-8-methoxyisothiazoloquinolones against methicillin-resistant Staphylococcus aureus (MRSA).EBI
J Med Chem 54: 3268-82 (2011)
Achillion Pharmaceuticals
Substituted imidazole of 5-fluoro-2-[4-[(2-phenyl-1H-imidazol-5-yl)methyl]-1-piperazinyl]pyrimidine Inactivates cytochrome P450 2D6 by protein adduction.EBI
Drug Metab Dispos 39: 974-83 (2011)
Kalamazoo College
Pharmacokinetics and hepatic uptake of eltrombopag, a novel platelet-increasing agent.EBI
Drug Metab Dispos 39: 1088-96 (2011)
Kanazawa University
Non-peptide NK1 receptor ligands based on the 4-phenylpyridine moiety.EBI
Bioorg Med Chem 19: 2242-51 (2011)
Universit£
Synthesis and evaluation of library of betulin derivatives against the botulinum neurotoxin A protease.EBI
Bioorg Med Chem Lett 21: 2229-31 (2011)
The Scripps Research Institute
Bicyclo[2.2.2]octyltriazole inhibitors of 11β-hydoxysteroid dehydrogenase type 1. Pharmacological agents for the treatment of metabolic syndrome.EBI
Bioorg Med Chem Lett 21: 2568-72 (2011)
Merck Research Laboratories
Synthesis and evaluation of thiophenyl derivatives as inhibitors of alkaline phosphatase.EBI
Bioorg Med Chem Lett 21: 2297-301 (2011)
Universit£
5'-Modified pyrimidine nucleosides as inhibitors of ribonuclease A.EBI
Bioorg Med Chem 19: 2478-84 (2011)
Indian Institute Of Technology
Using small molecules to target protein phosphatases.EBI
Bioorg Med Chem 19: 2145-55 (2011)
Max Planck Institute Of Molecular Physiology
Role of the side chain stereochemistry in thea-glucosidase inhibitory activity of kotalanol, a potent naturala-glucosidase inhibitor.EBI
Bioorg Med Chem 19: 2252-62 (2011)
Kinki University
Synthesis and SAR investigations of novel 2-arylbenzimidazole derivatives as melanin-concentrating hormone receptor 1 (MCH-R1) antagonists.EBI
Bioorg Med Chem Lett 21: 2309-12 (2011)
Korea Research Institute Of Chemical Technology
Virtual screening-driven identification of human carbonic anhydrase inhibitors incorporating an original, new pharmacophore.EBI
Bioorg Med Chem Lett 21: 2515-20 (2011)
Universit£
Design and synthesis of 1-(2-alkanamidoethyl)-6-methoxy-7-azaindole derivatives as potent melatonin agonists.EBI
Bioorg Med Chem Lett 21: 2316-9 (2011)
Universit£
Imidazopyridine CB2 agonists: optimization of CB2/CB1 selectivity and implications for in vivo analgesic efficacy.EBI
Bioorg Med Chem Lett 21: 2354-8 (2011)
Merck Research Laboratories
Alkyl piperidine and piperazine hydroxamic acids as HDAC inhibitors.EBI
Bioorg Med Chem Lett 21: 2305-8 (2011)
Menarini Ricerche Pomezia
Decahydroquinoline amides as highly selective CB2 agonists: role of selectivity on in vivo efficacy in a rodent model of analgesia.EBI
Bioorg Med Chem Lett 21: 2359-64 (2011)
Merck Research Laboratories
Discovery of spirocyclic sulfonamides as potent Akt inhibitors with exquisite selectivity against PKA.EBI
Bioorg Med Chem Lett 21: 2335-40 (2011)
Array Biopharma
Peptidomimetics containing a vinyl ketone warhead as falcipain-2 inhibitors.EBI
Eur J Med Chem 46: 2058-65 (2011)
University Of Messina
Design and synthesis of isoquinolines and benzimidazoles as RAF kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 2264-9 (2011)
Merck Serono
Design and SAR of macrocyclic Hsp90 inhibitors with increased metabolic stability and potent cell-proliferation activity.EBI
Bioorg Med Chem Lett 21: 2278-82 (2011)
Pfizer
N-acylaminophenothiazines: neuroprotective agents displaying multifunctional activities for a potential treatment of Alzheimer's disease.EBI
Eur J Med Chem 46: 2224-35 (2011)
Instituto De Qu£Mica M£Dica
Studying synergism of methyl linked cyclohexyl thiophenes with triazole: synthesis and their cdk5/p25 inhibition activity.EBI
Eur J Med Chem 46: 2066-74 (2011)
Dr. Reddy'S Laboratories, Ameerpet, Hyderabad, India.
Synthesis and biological evaluation of new 2-alkylaminoethyl-1,1-bisphosphonic acids against Trypanosoma cruzi and Toxoplasma gondii targeting farnesyl diphosphate synthase.EBI
Bioorg Med Chem 19: 2211-7 (2011)
Universidad De Buenos Aires
Design and optimisation of orally active TLR7 agonists for the treatment of hepatitis C virus infection.EBI
Bioorg Med Chem Lett 21: 2389-93 (2011)
Pfizer
Discovery and preliminary SARs of keto-indoles as novel indoleamine 2,3-dioxygenase (IDO) inhibitors.EBI
Eur J Med Chem 46: 3058-65 (2011)
University Of Namur
Novel interactions of fluorinated nucleotide derivatives targeting orotidine 5'-monophosphate decarboxylase.EBI
J Med Chem 54: 2891-901 (2011)
University Health Network
Structural modifications of UMP, UDP, and UTP leading to subtype-selective agonists for P2Y2, P2Y4, and P2Y6 receptors.EBI
J Med Chem 54: 2878-90 (2011)
University Of Bonn
Discovery, synthesis, and pharmacological evaluation of spiropiperidine hydroxamic acid based derivatives as structurally novel histone deacetylase (HDAC) inhibitors.EBI
J Med Chem 54: 3051-64 (2011)
Dac
Pyrazolo[4,3-d]pyrimidine bioisostere of roscovitine: evaluation of a novel selective inhibitor of cyclin-dependent kinases with antiproliferative activity.EBI
J Med Chem 54: 2980-93 (2011)
Palacky£? University And Institute Of Experimental Botany Ascr
5-Benzamidoisoquinolin-1-ones and 5-(κ-carboxyalkyl)isoquinolin-1-ones as isoform-selective inhibitors of poly(ADP-ribose) polymerase 2 (PARP-2).EBI
J Med Chem 54: 2049-59 (2011)
University Of Bath
Crystal structures of ABL-related gene (ABL2) in complex with imatinib, tozasertib (VX-680), and a type I inhibitor of the triazole carbothioamide class.EBI
J Med Chem 54: 2359-67 (2011)
Oxford University
Oxime amides as a novel zinc binding group in histone deacetylase inhibitors: synthesis, biological activity, and computational evaluation.EBI
J Med Chem 54: 2165-82 (2011)
Universita` Degli Studi Di Siena
Small-molecule ligands of methyl-lysine binding proteins.EBI
J Med Chem 54: 2504-11 (2011)
University Of North Carolina At Chapel Hill
Ethionamide boosters: synthesis, biological activity, and structure-activity relationships of a series of 1,2,4-oxadiazole EthR inhibitors.EBI
J Med Chem 54: 2994-3010 (2011)
University Of Lille
Homodimeric bis-quaternary heterocyclic ammonium salts as potent acetyl- and butyrylcholinesterase inhibitors: a systematic investigation of the influence of linker and cationic heads over affinity and selectivity.EBI
J Med Chem 54: 2627-45 (2011)
Universidad De Granada
Discovery of (1S,2R,3R)-2,3-dimethyl-2-phenyl-1-sulfamidocyclopropanecarboxylates: novel and highly selective aggrecanase inhibitors.EBI
J Med Chem 54: 2839-63 (2011)
Central Pharmaceutical Research Institute
Phenoxyacetic acids as PPARd partial agonists: synthesis, optimization, and in vivo efficacy.EBI
Bioorg Med Chem Lett 21: 2345-50 (2011)
Glaxosmithkline
Discovery of pyrrolo[2,3-d]pyrimidin-4-ones as corticotropin-releasing factor 1 receptor antagonists with a carbonyl-based hydrogen bonding acceptor.EBI
Bioorg Med Chem Lett 21: 2365-71 (2011)
Takeda Pharmaceutical
Novel pyrrolidine melanin-concentrating hormone receptor 1 antagonists with reduced hERG inhibition.EBI
Bioorg Med Chem Lett 21: 2460-7 (2011)
Amgen
Discovery of 2,4-bis-arylamino-1,3-pyrimidines as insulin-like growth factor-1 receptor (IGF-1R) inhibitors.EBI
Bioorg Med Chem Lett 21: 2394-9 (2011)
Amgen
Probing the inhibitor selectivity pocket of human 20?-hydroxysteroid dehydrogenase (AKR1C1) with X-ray crystallography and site-directed mutagenesis.EBI
Bioorg Med Chem Lett 21: 2564-7 (2011)
Monash University (Parkville Campus)
Synopsis of some recent tactical application of bioisosteres in drug design.EBI
J Med Chem 54: 2529-91 (2011)
Bristol-Myers Squibb Pharmaceutical Research And Development
Design of novel neurokinin 1 receptor antagonists based on conformationally constrained aromatic amino acids and discovery of a potent chimeric opioid agonist-neurokinin 1 receptor antagonist.EBI
J Med Chem 54: 2467-76 (2011)
Vrije Universiteit Brussel
A one-pot synthesis and biological activity of ageladine A and analogues.EBI
J Med Chem 54: 2492-503 (2011)
Macquarie University
Discovery of orally active carboxylic acid derivatives of 2-phenyl-5-trifluoromethyloxazole-4-carboxamide as potent diacylglycerol acyltransferase-1 inhibitors for the potential treatment of obesity and diabetes.EBI
J Med Chem 54: 2433-46 (2011)
Hoffmann-La Roche
Discovery of potent and selective inhibitors of ataxia telangiectasia mutated and Rad3 related (ATR) protein kinase as potential anticancer agents.EBI
J Med Chem 54: 2320-30 (2011)
Vertex Pharmaceuticals
Discovery of a benzo[e]pyrimido-[5,4-b][1,4]diazepin-6(11H)-one as a Potent and Selective Inhibitor of Big MAP Kinase 1.EBI
ACS Med Chem Lett 2: 195-200 (2011)
TBA
β-Branched acyclic nucleoside analogues as inhibitors of Plasmodium falciparum dUTPase.EBI
Bioorg Med Chem 19: 2378-91 (2011)
University Of Dundee
Synthesis, biological assessment and molecular modeling of 14-aryl-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-13-amines.EBI
Bioorg Med Chem Lett 21: 2384-8 (2011)
Universit£
Potential CRF1R PET imaging agents: N-fluoroalkyl-8-(6-methoxy-2-methylpyridin-3-yl)-2,7-dimethyl-N-alkylpyrazolo[1,5-a][1,3,5]triazin-4-amines.EBI
Bioorg Med Chem Lett 21: 2484-8 (2011)
Bristol-Myers Squibb Research And Development
Design, synthesis and structure-activity relationships of (indo-3-yl) heterocyclic derivatives as agonists of the CB1 receptor. Discovery of a clinical candidate.EBI
Bioorg Med Chem Lett 21: 2541-6 (2011)
Merck Research Laboratories
Evaluation of dihydropyrimidin-(2H)-one analogues and rhodanine derivatives as tyrosinase inhibitors.EBI
Bioorg Med Chem Lett 21: 2376-9 (2011)
Shaoyang University
Symmetric double-headed aminopyridines, a novel strategy for potent and membrane-permeable inhibitors of neuronal nitric oxide synthase.EBI
J Med Chem 54: 2039-48 (2011)
Northwestern University
The preparation, in vitro screening and molecular docking of symmetrical bisquaternary cholinesterase inhibitors containing a but-(2E)-en-1,4-diyl connecting linkage.BDB
J Enzyme Inhib Med Chem 26: 245-53 (2011)
University Of Defence
The evaluation of inhibitive effectiveness of the tumour necrosis factor-a converting enzyme selective inhibitors by HPLC.BDB
J Enzyme Inhib Med Chem 26: 181-7 (2011)
Huazhong University Of Science And Technology
Homoisoflavonoids: natural scaffolds with potent and selective monoamine oxidase-B inhibition properties.EBI
J Med Chem 54: 2155-64 (2011)
Sapienza University Of Rome
Synthesis and c-Met kinase inhibition of 3,5-disubstituted and 3,5,7-trisubstituted quinolines: identification of 3-(4-acetylpiperazin-1-yl)-5-(3-nitrobenzylamino)-7- (trifluoromethyl)quinoline as a novel anticancer agent.EBI
J Med Chem 54: 2127-42 (2011)
Chinese Academy Of Sciences
Novel hydrazine molecules as tools to understand the flexibility of vascular adhesion protein-1 ligand-binding site: toward more selective inhibitors.EBI
J Med Chem 54: 2143-54 (2011)
University Of Jyva£Skyla£
Carbonic anhydrase inhibitors. Inhibition of the β-class enzymes from the fungal pathogens Candida albicans and Cryptococcus neoformans with branched aliphatic/aromatic carboxylates and their derivatives.EBI
Bioorg Med Chem Lett 21: 2521-6 (2011)
Universit£
The identification of the 2-phenylphthalazin-1(2H)-one scaffold as a new decorable core skeleton for the design of potent and selective human A3 adenosine receptor antagonists.EBI
J Med Chem 54: 2102-13 (2011)
Universita` Degli Studi Di Firenze
In vitro characterization of human peptide transporter hPEPT1 interactions and passive permeation studies of short cationic antimicrobial peptides.EBI
J Med Chem 54: 2422-32 (2011)
University Of Troms£
Potent and selective adenosine A(2A) receptor antagonists: [1,2,4]-triazolo[4,3-c]pyrimidin-3-ones.EBI
Bioorg Med Chem Lett 21: 2497-501 (2011)
Merck Research Laboratories
Discovery of non-glucoside SGLT2 inhibitors.EBI
Bioorg Med Chem Lett 21: 2472-5 (2011)
Amgen
The discovery of novel, potent and highly selective inhibitors of inducible nitric oxide synthase (iNOS).EBI
Bioorg Med Chem Lett 21: 2468-71 (2011)
Astrazeneca Charnwood
Design and synthesis of pyridin-2-yloxymethylpiperidin-1-ylbutyl amide CCR5 antagonists that are potent inhibitors of M-tropic (R5) HIV-1 replication.EBI
Bioorg Med Chem Lett 21: 2450-5 (2011)
Genzyme
2-(4-Carbonylphenyl)benzoxazole inhibitors of CETP: attenuation of hERG binding and improved HDLc-raising efficacy.EBI
Bioorg Med Chem Lett 21: 2597-600 (2011)
Merck Research Laboratories
An expeditious access to 5-pyrimidinol derivatives from cyclic methylglyoxal diadducts, formation of argpyrimidines under physiological conditions and discovery of new CFTR inhibitors.EBI
Eur J Med Chem 46: 1935-41 (2011)
University Joseph Fourier-Grenoble 1/Cnrs
Benzophenone-based derivatives: a novel series of potent and selective dual inhibitors of acetylcholinesterase and acetylcholinesterase-induced beta-amyloid aggregation.EBI
Eur J Med Chem 46: 1682-93 (2011)
University Of Bologna
Synthesis, biological evaluation and molecular modeling of novel triazole-containing berberine derivatives as acetylcholinesterase and β-amyloid aggregation inhibitors.EBI
Bioorg Med Chem 19: 2298-305 (2011)
Sun Yat-Sen University
Exploration of new scaffolds as potential MAO-A inhibitors using pharmacophore and 3D-QSAR based in silico screening.EBI
Bioorg Med Chem Lett 21: 2419-24 (2011)
Bharati Vidyapeeth Deemed University
Preparation, in vitro screening and molecular modelling of symmetrical bis-quinolinium cholinesterase inhibitors--implications for early myasthenia gravis treatment.EBI
Bioorg Med Chem Lett 21: 2505-9 (2011)
Charles University
Synthesis and biological activity of hydroxy substituted phenyl-benzo[d]thiazole analogues for antityrosinase activity in B16 cells.EBI
Bioorg Med Chem Lett 21: 2445-9 (2011)
Pusan National University
Discovery of non-peptide, small molecule antagonists ofa9a10 nicotinic acetylcholine receptors as novel analgesics for the treatment of neuropathic and tonic inflammatory pain.EBI
Bioorg Med Chem Lett 21: 2476-9 (2011)
University Of Kentucky
Selectivea-glucosidase substrates and inhibitors containing short aromatic peptidyl moieties.EBI
Bioorg Med Chem Lett 21: 2441-4 (2011)
Seoul National University
SPF32629A and SPF32629B: enantioselective synthesis, determination of absolute configuration, cytotoxicity and antibacterial evaluation.EBI
Eur J Med Chem 46: 1803-12 (2011)
Gvk Biosciences
Identification and optimization of tetrahydro-2H-3-benzazepin-2-ones as squalene synthase inhibitors.EBI
Bioorg Med Chem Lett 21: 2554-8 (2011)
Bayer Pharma
Discovery of a potent peptidic cyclophilin A inhibitor Trp-Gly-Pro.EBI
Eur J Med Chem 46: 1701-5 (2011)
Fudan University
Preparation and evaluation of tetrabenazine enantiomers and all eight stereoisomers of dihydrotetrabenazine as VMAT2 inhibitors.EBI
Eur J Med Chem 46: 1841-8 (2011)
China Pharmaceutical University
Structural basis for the interaction between carbonic anhydrase and 1,2,3,4-tetrahydroisoquinolin-2-ylsulfonamides.EBI
J Med Chem 54: 2522-6 (2011)
Academy Of Sciences Of The Czech Republic
Design, synthesis, and evaluation of novel 3,6-diaryl-4-aminoalkoxyquinolines as selective agonists of somatostatin receptor subtype 2.EBI
J Med Chem 54: 2351-8 (2011)
Merck Research Laboratories
Susceptibility and mode of binding of the Mycobacterium tuberculosis cysteinyl transferase mycothiol ligase to tRNA synthetase inhibitors.EBI
Bioorg Med Chem Lett 21: 2480-3 (2011)
National Institute Of Diabetes And Digestive And Kidney Diseases
6-Benzoyl-3-hydroxypyrimidine-2,4-diones as dual inhibitors of HIV reverse transcriptase and integrase.EBI
Bioorg Med Chem Lett 21: 2400-2 (2011)
University Of Minnesota
Design and synthesis of several small-size HTLV-I protease inhibitors with different hydrophilicity profiles.EBI
Bioorg Med Chem Lett 21: 2425-9 (2011)
Kyoto Pharmaceutical University
Identification of potent, noncovalent fatty acid amide hydrolase (FAAH) inhibitors.EBI
Bioorg Med Chem Lett 21: 2492-6 (2011)
Amgen
Synthesis and SAR of novel benzoxaboroles as a new class of β-lactamase inhibitors.EBI
Bioorg Med Chem Lett 21: 2533-6 (2011)
Anacor Pharmaceuticals
Discovery and SAR of spirochromane Akt inhibitors.EBI
Bioorg Med Chem Lett 21: 2410-4 (2011)
Array Biopharma
Synthesis and biological evaluation of dibenz[b,f][1,5]oxazocine derivatives for agonist activity at κ-opioid receptor.EBI
Eur J Med Chem 46: 1713-20 (2011)
Indian Institute Of Chemical Biology
Preparation and pharmacological evaluation of a novel series of 2-(phenylthio)benzo[b]thiophenes as selective MT2 receptor ligands.EBI
Eur J Med Chem 46: 1835-40 (2011)
University Of Lille
Small molecule agonists of the orphan nuclear receptors steroidogenic factor-1 (SF-1, NR5A1) and liver receptor homologue-1 (LRH-1, NR5A2).EBI
J Med Chem 54: 2266-81 (2011)
University Of Southampton
Role of metalation in the topoisomerase IIa inhibition and antiproliferation activity of a series ofa-heterocyclic-N4-substituted thiosemicarbazones and their Cu(II) complexes.EBI
J Med Chem 54: 2391-8 (2011)
Memorial Sloan-Kettering Cancer Center
Discovery and structure-activity relationship of 3-aminopyrid-2-ones as potent and selective interleukin-2 inducible T-cell kinase (Itk) inhibitors.EBI
J Med Chem 54: 2341-50 (2011)
Vertex Pharmaceuticals
Synthesis and in vivo evaluation of (S)-6-(4-fluorophenoxy)-3-((1-[11C]methylpiperidin-3-yl)methyl)-2-o-tolylquinazolin-4(3H)-one, a potential PET tracer for growth hormone secretagogue receptor (GHSR).EBI
Bioorg Med Chem 19: 2368-72 (2011)
The Johns Hopkins University School Of Medicine
Discovery of benzothiazole-based adenosine A2B receptor antagonists with improved A2A selectivity.EBI
Bioorg Med Chem Lett 21: 1933-6 (2011)
Roche Research Center
Structure based design, synthesis and SAR of cyclic hydroxyethylamine (HEA) BACE-1 inhibitors.EBI
Bioorg Med Chem Lett 21: 1942-7 (2011)
Novartis Institutes For Biomedical Research
Synthesis, anti-inflammatory activity and COX-1/COX-2 inhibition of novel substituted cyclic imides. Part 1: Molecular docking study.EBI
Eur J Med Chem 46: 1648-55 (2011)
King Saud University
Glycoglycerolipid analogues inhibit PKC translocation to the plasma membrane and downstream signaling pathways in PMA-treated fibroblasts and human glioblastoma cells, U87MG.EBI
Eur J Med Chem 46: 1827-34 (2011)
University Of Milan
Highly potent 5-aminotetrahydropyrazolopyridines: enantioselective dopamine D3 receptor binding, functional selectivity, and analysis of receptor-ligand interactions.EBI
J Med Chem 54: 2477-91 (2011)
Friedrich-Alexander University
Design and synthesis of imidazopyridine analogues as inhibitors of phosphoinositide 3-kinase signaling and angiogenesis.EBI
J Med Chem 54: 2455-66 (2011)
Korea Advanced Institute Of Science And Technology
Pro-soft Val-boroPro: a strategy for enhancing in vivo performance of boronic acid inhibitors of serine proteases.EBI
J Med Chem 54: 2022-8 (2011)
Tufts University Sackler School Of Graduate Biomedical Sciences
Synthesis, biological evaluation and molecular modeling studies of quinolonyl diketo acid derivatives: new structural insight into the HIV-1 integrase inhibition.EBI
Eur J Med Chem 46: 1749-56 (2011)
Facult£S Universitaires Notre-Dame De La Paix (Fundp)
Fine-tuning the selectivity of aldosterone synthase inhibitors: structure-activity and structure-selectivity insights from studies of heteroaryl substituted 1,2,5,6-tetrahydropyrrolo[3,2,1-ij]quinolin-4-one derivatives.EBI
J Med Chem 54: 2307-19 (2011)
Saarland University
Design, synthesis and biological activity of thiazolidine-4-carboxylic acid derivatives as novel influenza neuraminidase inhibitors.EBI
Bioorg Med Chem 19: 2342-8 (2011)
Shandong University
Syntheses of 2-deoxy-2,3-didehydro-N-acetylneuraminic acid analogues modified by N-sulfonylamidino groups at the C-4 position and biological evaluation as inhibitors of human parainfluenza virus type 1.EBI
Bioorg Med Chem 19: 2418-27 (2011)
University Of Shizuoka
Enantioselective synthesis of tranylcypromine analogues as lysine demethylase (LSD1) inhibitors.EBI
Bioorg Med Chem 19: 3709-16 (2011)
University Of Southampton
Synthesis and biological evaluation of fused oxepinocoumarins as free radicals scavengers.BDB
J Enzyme Inhib Med Chem 26: 805-12 (2011)
Aristotle University Of Thessaloniki
Macrocycles are great cycles: applications, opportunities, and challenges of synthetic macrocycles in drug discovery.EBI
J Med Chem 54: 1961-2004 (2011)
Universite£
The discovery of phthalazinone-based human H1 and H3 single-ligand antagonists suitable for intranasal administration for the treatment of allergic rhinitis.EBI
J Med Chem 54: 2183-95 (2011)
Glaxosmithkline
Synthesis and biological evaluation of novel 5-benzylidenethiazolidine-2,4-dione derivatives for the treatment of inflammatory diseases.EBI
J Med Chem 54: 2060-8 (2011)
Sichuan University
Design and evaluation of fragment-like estrogen receptor tetrahydroisoquinoline ligands from a scaffold-detection approach.EBI
J Med Chem 54: 2005-11 (2011)
Technische Universiteit Eindhoven
Structures of 1-Deoxy-D-Xylulose-5-Phosphate Reductoisomerase/Lipophilic Phosphonate Complexes.EBI
ACS Med Chem Lett 2: 165-170 (2011)
Baylor College Of Medicine
Development of selective and reversible pyrazoline based MAO-B inhibitors: virtual screening, synthesis and biological evaluation.EBI
Bioorg Med Chem Lett 21: 1969-73 (2011)
Birla Institute Of Technology
Sargachromanols as inhibitors of Na+/K+ ATPase and isocitrate lyase.EBI
Bioorg Med Chem Lett 21: 1958-61 (2011)
Seoul National University
Synthesis and pharmacological evaluation of novel benzoylazole-based PPARa/κ activators.EBI
Bioorg Med Chem Lett 21: 1978-82 (2011)
Dainippon Sumitomo Pharma
Synthesis and structure-activity relationships of phenylpropanoid amides of serotonin on tyrosinase inhibition.EBI
Bioorg Med Chem Lett 21: 1983-6 (2011)
Kinki University
C20-trifluoro-5-oxo-ETE: a metabolically stable 5-oxo-ETE derivative.EBI
Bioorg Med Chem Lett 21: 1987-90 (2011)
Florida Institute Of Technology
Synthesis and biological evaluation of a diazepanone-based library of liposidomycins analogs as MraY inhibitors.EBI
Eur J Med Chem 46: 1582-92 (2011)
University Of Paris
Pharmacophore-based virtual screening and Bayesian model for the identification of potential human leukotriene A4 hydrolase inhibitors.EBI
Eur J Med Chem 46: 1593-603 (2011)
Gyeongsang National University (Gnu)
Design and synthesis of naphthalenic derivatives as new ligands at the melatonin binding site MT3.EBI
Eur J Med Chem 46: 1622-9 (2011)
University Of Lille
Purification and inhibition studies with anions and sulfonamides of ana-carbonic anhydrase from the Antarctic seal Leptonychotes weddellii.EBI
Bioorg Med Chem 19: 1847-51 (2011)
Universit£
Synthesis of new glycyrrhetinic acid derived ring A azepanone, 29-urea and 29-hydroxamic acid derivatives as selective 11ß-hydroxysteroid dehydrogenase 2 inhibitors.EBI
Bioorg Med Chem 19: 1866-80 (2011)
University Of Technology
Effect of structural modification in the amine portion of substituted aminobutyl-benzamides as ligands for bindings1 ands2 receptors.EBI
Bioorg Med Chem 19: 1852-9 (2011)
University Of Missouri-Columbia
Discovery of indole alkaloids with cannabinoid CB1 receptor antagonistic activity.EBI
Bioorg Med Chem Lett 21: 1962-4 (2011)
Chiba University
Hybrid compounds as new Bcr/Abl inhibitors.EBI
Bioorg Med Chem Lett 21: 1965-8 (2011)
Chinese Academy Of Sciences
Discovery of 3-aryl-5-acylpiperazinyl-pyrazoles as antagonists to the NK3 receptor.EBI
Bioorg Med Chem Lett 21: 1991-6 (2011)
Euroscreen
Discovery of triazine-benzimidazoles as selective inhibitors of mTOR.EBI
Bioorg Med Chem Lett 21: 2064-70 (2011)
Amgen
Pyrimidine-2,4,6-trione derivatives and their inhibition of mutant SOD1-dependent protein aggregation. Toward a treatment for amyotrophic lateral sclerosis.EBI
J Med Chem 54: 2409-21 (2011)
Northwestern University
Discovery of 6-(2,4-difluorophenoxy)-2-[3-hydroxy-1-(2-hydroxyethyl)propylamino]-8-methyl-8H-pyrido[2,3-d]pyrimidin-7-one (pamapimod) and 6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-pyran-4-ylamino)pyrido[2,3-d]pyrimidin-7(8H)-one (R1487) as orally bioavailable and highly selective inhibitorsEBI
J Med Chem 54: 2255-65 (2011)
Roche Palo Alto
Synthesis, biological evaluation and 3D-QSAR studies of 3-keto salicylic acid chalcones and related amides as novel HIV-1 integrase inhibitors.EBI
Bioorg Med Chem 19: 2030-45 (2011)
University Of Tennessee Health Science Center
In silico and in vitro validation of serine hydroxymethyltransferase as a chemotherapeutic target of the antifolate drug pemetrexed.EBI
Eur J Med Chem 46: 1616-21 (2011)
Sapienza University Of Rome
New glucocerebrosidase inhibitors by exploration of chemical diversity of N-substituted aminocyclitols using click chemistry and in situ screening.EBI
J Med Chem 54: 2069-79 (2011)
Spanish National Research Council (Consejo Superior De Investigaciones Cienti£?Ficas)
Design and synthesis of potent and selective aldose reductase inhibitors based on pyridylthiadiazine scaffold.EBI
Eur J Med Chem 46: 1536-44 (2011)
Beijing Institute Of Technology
Syntheses and characterization of novel oxoisoaporphine derivatives as dual inhibitors for cholinesterases and amyloid beta aggregation.EBI
Eur J Med Chem 46: 1572-81 (2011)
Sun Yat-Sen University
1-[(1-methyl-1H-imidazol-2-yl)methyl]-4-phenylpiperidines as mGluR2 positive allosteric modulators for the treatment of psychosis.EBI
J Med Chem 54: 1724-39 (2011)
Pfizer
Benzimidazole inhibitors induce a DFG-out conformation of never in mitosis gene A-related kinase 2 (Nek2) without binding to the back pocket and reveal a nonlinear structure-activity relationship.EBI
J Med Chem 54: 1626-39 (2011)
The Institute Of Cancer Research
Synthesis of new (-)-bestatin-based inhibitor libraries reveals a novel binding mode in the S1 pocket of the essential malaria M1 metalloaminopeptidase.EBI
J Med Chem 54: 1655-66 (2011)
University Of Pennsylvania
Indolylarylsulfones as HIV-1 non-nucleoside reverse transcriptase inhibitors: new cyclic substituents at indole-2-carboxamide.EBI
J Med Chem 54: 1587-98 (2011)
Sapienza University Of Rome
Quinazoline sulfonamides as dual binders of the proteins B-cell lymphoma 2 and B-cell lymphoma extra long with potent proapoptotic cell-based activity.EBI
J Med Chem 54: 1914-26 (2011)
The Walter And Eliza Hall Institute Of Medical Research
Discovery of a potent and efficacious peptide derivative ford/µ opioid agonist/neurokinin 1 antagonist activity with a 2',6'-dimethyl-L-tyrosine: in vitro, in vivo, and NMR-based structural studies.EBI
J Med Chem 54: 2029-38 (2011)
University Of Arizona
Ureido-substituted benzenesulfonamides potently inhibit carbonic anhydrase IX and show antimetastatic activity in a model of breast cancer metastasis.EBI
J Med Chem 54: 1896-902 (2011)
Universita` Degli Studi Di Firenze
Activation of the G-protein-coupled receptor 119: a conformation-based hypothesis for understanding agonist response.EBI
J Med Chem 54: 1948-52 (2011)
Pfizer
Discovery of novel SCD1 inhibitors: 5-alkyl-4,5-dihydro-3H-spiro[1,5-benzoxazepine-2,4'-piperidine] analogs.EBI
Eur J Med Chem 46: 1892-6 (2011)
Daiichi Sankyo
Zwitterionic CRTh2 antagonists.EBI
J Med Chem 54: 1779-88 (2011)
Astrazeneca R&D Charnwood
Structure-activity relationships of flavonoids as inhibitors of breast cancer resistance protein (BCRP).EBI
Bioorg Med Chem 19: 2090-102 (2011)
University Of Bonn
1,4-Diazepane compounds as potent and selective CB2 agonists: optimization of metabolic stability.EBI
Bioorg Med Chem Lett 21: 2011-6 (2011)
Boehringer Ingelheim Pharmaceuticals
Pyridinesulfonylureas and pyridinesulfonamides as selective bombesin receptor subtype-3 (BRS-3) agonists.EBI
Bioorg Med Chem Lett 21: 2040-3 (2011)
Merck Research Laboratories
Structure-based virtual screening approach to the discovery of phosphoinositide 3-kinase alpha inhibitors.EBI
Bioorg Med Chem Lett 21: 2021-4 (2011)
Sejong University
The many faces of the adamantyl group in drug design.EBI
Eur J Med Chem 46: 1949-63 (2011)
University Of Sydney
Development of sulfonamide AKT PH domain inhibitors.EBI
Bioorg Med Chem 19: 2046-54 (2011)
The University Of Arizona
Synthesis and biological testing of novel pyridoisothiazolones as histone acetyltransferase inhibitors.EBI
Bioorg Med Chem 19: 3678-89 (2011)
Albert-Ludwigs-University Of Freiburg
Discovery of a new 2-aminobenzhydrol template for highly potent squalene synthase inhibitors.EBI
Bioorg Med Chem 19: 1930-49 (2011)
Daiichi Sankyo
8-Hydroxynaphthalene-1,4-dione derivative as novel compound for glioma treatment.EBI
Bioorg Med Chem Lett 21: 2079-82 (2011)
University Of Padova
Discovery of PF-00217830: aryl piperazine napthyridinones as D2 partial agonists for schizophrenia and bipolar disorder.EBI
Bioorg Med Chem Lett 21: 2621-5 (2011)
Pfizer
Structure based design and syntheses of amino-1H-pyrazole amide derivatives as selective Raf kinase inhibitors in melanoma cells.EBI
Bioorg Med Chem 19: 1915-23 (2011)
Hanyang University
Novel and potent calcium-sensing receptor antagonists: discovery of (5R)-N-[1-ethyl-1-(4-ethylphenyl)propyl]-2,7,7-trimethyl-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide monotosylate (TAK-075) as an orally active bone anabolic agent.EBI
Bioorg Med Chem 19: 1881-94 (2011)
Takeda Pharmaceutical
A rational approach for the design and synthesis of 1-acetyl-3,5-diaryl-4,5-dihydro(1H)pyrazoles as a new class of potential non-purine xanthine oxidase inhibitors.EBI
Bioorg Med Chem 19: 1950-8 (2011)
Indo-Soviet Friendship College Of Pharmacy
Imidazo[1,5-a]pyrazines: orally efficacious inhibitors of mTORC1 and mTORC2.EBI
Bioorg Med Chem Lett 21: 2092-7 (2011)
Osi Pharmaceuticals
Identification and evaluation of soft coral diterpenes as inhibitors of HIF-2a induced gene expression.EBI
Bioorg Med Chem Lett 21: 2113-5 (2011)
Nci-Frederick
Impact of aryloxy-linked quinazolines: a novel series of selective VEGFR-2 receptor tyrosine kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 2106-12 (2011)
University Of Lille
Structure-activity relationship study of 2,4-diaminothiazoles as Cdk5/p25 kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 2098-101 (2011)
Harvard Medical School
Design of a novel pyrrolidine scaffold utilized in the discovery of potent and selective humanß3 adrenergic receptor agonists.EBI
Bioorg Med Chem Lett 21: 1865-70 (2011)
Merck Research Laboratories
Synthesis and SAR studies of novel 2-(4-oxo-2-aryl-quinazolin-3(4H)-yl)acetamide vasopressin V1b receptor antagonists.EBI
Bioorg Med Chem Lett 21: 1871-5 (2011)
Msd
Development of imidazole alkanoic acids as mGAT3 selective GABA uptake inhibitors.EBI
Eur J Med Chem 46: 1483-98 (2011)
Ludwig-Maximilians-University Munich
Aminothiazolomorphinans with mixed¿ andµ opioid activity.EBI
J Med Chem 54: 1903-13 (2011)
Harvard Medical School
Syntheses and characterization of nimesulide derivatives for dual enzyme inhibitors of both cyclooxygenase-1/2 and 5-lipoxygenase.EBI
Bioorg Med Chem 19: 2074-83 (2011)
Sun Yat-Sen University
Parallel solid-phase synthesis of a small library of linear and hydrocarbon-bridged analogues of VEGF(81-91): potential biological tools for studying the VEGF/VEGFR-1 interaction.EBI
Bioorg Med Chem 19: 1978-86 (2011)
Instituto De Qu£Mica M£Dica
CD22-antagonists with nanomolar potency: the synergistic effect of hydrophobic groups at C-2 and C-9 of sialic acid scaffold.EBI
Bioorg Med Chem 19: 1966-71 (2011)
Gifu University
Tetrahydroquinolin-3-yl carbamate glucocorticoid receptor agonists with reduced PEPCK activation.EBI
Bioorg Med Chem Lett 21: 1658-62 (2011)
Ligand Pharmaceuticals
Synthesis and biological evaluation of 4-quinazolinones as Rho kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 1844-8 (2011)
Translational Research Institute
Design and synthesis of tricyclic tetrahydroquinolines as a new series of nonsteroidal selective androgen receptor modulators (SARMs).EBI
Bioorg Med Chem Lett 21: 1744-7 (2011)
Kaken Pharmaceutical
The discovery of potent and long-acting oral factor Xa inhibitors with tetrahydroisoquinoline and benzazepine P4 motifs.EBI
Bioorg Med Chem Lett 21: 1588-92 (2011)
Glaxosmithkline
Structure and property based design of factor Xa inhibitors: pyrrolidin-2-ones with aminoindane and phenylpyrrolidine P4 motifs.EBI
Bioorg Med Chem Lett 21: 1582-7 (2011)
Glaxosmithkline
Exploring new near-infrared fluorescent disulfide-based cyclic RGD peptide analogs for potential integrin-targeted optical imaging.EBI
Bioorg Med Chem Lett 21: 2116-20 (2011)
Washington University
Synthesis and biological activity of novel N6-substituted and 2,N6-disubstituted adenine ribo- and 3'-C-methyl-ribonucleosides as antitumor agents.EBI
Eur J Med Chem 46: 1499-504 (2011)
University Of Camerino
Synthesis and pharmacological evaluation of fluorine-containing D3 dopamine receptor ligands.EBI
J Med Chem 54: 1555-64 (2011)
Washington University
Triazole ligands reveal distinct molecular features that induce histamine H4 receptor affinity and subtly govern H4/H3 subtype selectivity.EBI
J Med Chem 54: 1693-703 (2011)
Vu University Amsterdam
Metabolism of the c-Fos/activator protein-1 inhibitor T-5224 by multiple human UDP-glucuronosyltransferase isoforms.EBI
Drug Metab Dispos 39: 803-13 (2011)
Toyama Chemical
Isolation, structure identification and SAR studies on thiosugar sulfonium salts, neosalaprinol and neoponkoranol, as potenta-glucosidase inhibitors.EBI
Bioorg Med Chem 19: 2015-22 (2011)
Kinki University
Design, synthesis and SAR of novel ethylenediamine and phenylenediamine derivatives as factor Xa inhibitors.EBI
Bioorg Med Chem Lett 21: 2133-40 (2011)
Daiichi Sankyo
Synthesis, biological evaluation and molecular docking studies of stellatin derivatives as cyclooxygenase (COX-1, COX-2) inhibitors and anti-inflammatory agents.EBI
Bioorg Med Chem Lett 21: 1612-6 (2011)
National Institute Of Pharmaceutical Education And Research (Niper)
Antioxidant xanthone derivatives induce cell cycle arrest and apoptosis and enhance cell death induced by cisplatin in NTUB1 cells associated with ROS.EBI
Eur J Med Chem 46: 1222-31 (2011)
Kaohsiung Medical University
Structure-activity relationship and multidrug resistance study of new S-trityl-L-cysteine derivatives as inhibitors of Eg5.EBI
J Med Chem 54: 1576-86 (2011)
Institute For Cancer Research
Improvement in aqueous solubility in small molecule drug discovery programs by disruption of molecular planarity and symmetry.EBI
J Med Chem 54: 1539-54 (2011)
The University Of Tokyo
Structure-Activity Relationships at the Monoamine Transporters for a Novel Series of Modafinil (2-[(diphenylmethyl)sulfinyl]acetamide) Analogues.EBI
ACS Med Chem Lett 2: 48-52 (2011)
National Institute On Drug Abuse-Intramural Research Program
A novel approach for predicting P-glycoprotein (ABCB1) inhibition using molecular interaction fields.EBI
J Med Chem 54: 1740-51 (2011)
University Of Perugia
A class of 5-benzylidene-2-phenylthiazolinones with high potency as direct 5-lipoxygenase inhibitors.EBI
J Med Chem 54: 1943-7 (2011)
Goethe-University Frankfurt
Design, synthesis, and biological evaluation of imidazolyl derivatives of 4,7-disubstituted coumarins as aromatase inhibitors selective over 17-a-hydroxylase/C17-20 lyase.EBI
J Med Chem 54: 1613-25 (2011)
Universita` Degli Studi Di Bari Aldo Moro
Discovery, optimization, and pharmacological characterization of novel heteroaroylphenylureas antagonists of C-C chemokine ligand 2 function.EBI
J Med Chem 54: 1667-81 (2011)
Telik
Design and optimization of potent and orally bioavailable tetrahydronaphthalene Raf inhibitors.EBI
J Med Chem 54: 1836-46 (2011)
Millennium Pharmaceuticals
Structure-based design of potent and selective 3-phosphoinositide-dependent kinase-1 (PDK1) inhibitors.EBI
J Med Chem 54: 1871-95 (2011)
Glaxosmithkline
Discovery of a novel series of inhibitors of lymphoid tyrosine phosphatase with activity in human T cells.EBI
J Med Chem 54: 1640-54 (2011)
University Of Southern California
Unique neonicotinoid binding conformations conferring selective receptor interactions.EBI
J Agric Food Chem 59: 2825-8 (2011)
Gifu University
Opioid receptor probes derived from cycloaddition of the hallucinogen natural product salvinorin A.EBI
J Nat Prod 74: 718-26 (2011)
University Of Iowa
Design and synthesis of conformationally constrained cyclophilin inhibitors showing a cyclosporin-A phenotype in C. elegans.BDB
Chembiochem 12: 802-10 (2011)
The University Of Edinburgh
Further SAR study on 11-O-substituted aporphine analogues: identification of highly potent dopamine D3 receptor ligands.EBI
Bioorg Med Chem 19: 1999-2008 (2011)
Chinese Academy Of Sciences
Antiviral activity of seed extract from Citrus bergamia towards human retroviruses.EBI
Bioorg Med Chem 19: 2084-9 (2011)
University Of Rome Tor Vergata
Discovery of histone deacetylase 8 selective inhibitors.EBI
Bioorg Med Chem Lett 21: 2601-5 (2011)
Howard Hughes Medical Institute
Substituted phenyl triazoles as selective inhibitors of 11 β-Hydroxysteroid Dehydrogenase Type 1.EBI
Bioorg Med Chem Lett 21: 2141-5 (2011)
Merck
Pharmacokinetic optimisation of novel indole-2-carboxamide cannabinoid CB1 antagonists.EBI
Bioorg Med Chem Lett 21: 2034-9 (2011)
Msd
Probing the isoprenylcysteine carboxyl methyltransferase (Icmt) binding pocket: sulfonamide modified farnesyl cysteine (SMFC) analogs as Icmt inhibitors.EBI
Bioorg Med Chem Lett 21: 2616-20 (2011)
Purdue University
Structure-based design and biological profile of (E)-N-(4-Nitrobenzylidene)-2-naphthohydrazide, a novel small molecule inhibitor of I¿B kinase-ß.EBI
Eur J Med Chem 46: 1245-53 (2011)
Universidade Federal Do Rio De Janeiro
Synthesis and evaluation of bibenzyl glycosides as potent tyrosinase inhibitors.EBI
Eur J Med Chem 46: 1374-81 (2011)
Utsunomiya University
Antidotes to anthrax lethal factor intoxication. Part 2: structural modifications leading to improved in vivo efficacy.EBI
Bioorg Med Chem Lett 21: 2030-3 (2011)
Panthera Biopharma
Novel analogues of ketamine and phencyclidine as NMDA receptor antagonists.EBI
Bioorg Med Chem Lett 21: 2059-63 (2011)
Glaxosmithkline Medicines Research Centre
Discovery of potent dipeptidyl peptidase IV inhibitors derived fromß-aminoamides bearing substituted [1,2,3]-triazolopiperidines for the treatment of type 2 diabetes.EBI
Bioorg Med Chem Lett 21: 1731-5 (2011)
Shandong University Of Traditional Chinese Medicine
Synthesis and evaluation of novel pyrimidine-based dual EGFR/Her-2 inhibitors.EBI
Bioorg Med Chem Lett 21: 1601-6 (2011)
Shionogi
Synthesis and biological evaluation of indazole derivatives.EBI
Eur J Med Chem 46: 1439-47 (2011)
Uned
Development of 2,4-diaminopyrimidine derivatives as novel SNSR4 antagonists.EBI
Bioorg Med Chem Lett 21: 2102-5 (2011)
Astrazeneca R&D Montreal
2-Substituted 5,6-dimethyl-3-phenylsulfonyl-pyrazolo[1,5-a]pyrimidines: new series of highly potent and specific serotonin 5-HT6 receptor antagonists.EBI
Eur J Med Chem 46: 1189-97 (2011)
Chemical Diversity Research Institute
Discovery of N-hydroxyindole-based inhibitors of human lactate dehydrogenase isoform A (LDH-A) as starvation agents against cancer cells.EBI
J Med Chem 54: 1599-612 (2011)
Universita` Di Pisa
Discovery and optimization of a series of benzothiazole phosphoinositide 3-kinase (PI3K)/mammalian target of rapamycin (mTOR) dual inhibitors.EBI
J Med Chem 54: 1789-811 (2011)
Amgen
Natural product-based phenols as novel probes for mycobacterial and fungal carbonic anhydrases.EBI
J Med Chem 54: 1682-92 (2011)
Griffith University
Discovery of new inhibitor for PDE3 by virtual screening.EBI
Bioorg Med Chem Lett 21: 1617-20 (2011)
Korea Research Institute Of Chemical Technology
Synthesis and pharmacological evaluation of bivalent antagonists of the nociceptin opioid receptor.EBI
Eur J Med Chem 46: 1207-21 (2011)
Istituto Superiore Di Sanit£
Design, synthesis and X-ray crystallographic study of NAmPRTase inhibitors as anti-cancer agents.EBI
Eur J Med Chem 46: 1153-64 (2011)
School Of Life Science
Synthesis and biological evaluation of unsaturated keto and exomethylene D-arabinopyranonucleoside analogs: novel 5-fluorouracil analogs that target thymidylate synthase.EBI
Eur J Med Chem 46: 993-1005 (2011)
University Of Thessaly
Discovery of novel (4-piperidinyl)-piperazines as potent and orally active acetyl-CoA carboxylase 1/2 non-selective inhibitors: F-Boc and triF-Boc groups are acid-stable bioisosteres for the Boc group.EBI
Bioorg Med Chem 19: 1580-93 (2011)
Taisho Pharmaceutical
Cofactor-type inhibitors of inosine monophosphate dehydrogenase via modular approach: targeting the pyrophosphate binding sub-domain.EBI
Bioorg Med Chem 19: 1594-605 (2011)
University Of Minnesota
N-benzylimidazole carboxamides as potent, orally active stearoylCoA desaturase-1 inhibitors.EBI
Bioorg Med Chem Lett 21: 1621-5 (2011)
Pfizer
Nonsteroidal 2,3-dihydroquinoline glucocorticoid receptor agonists with reduced PEPCK activation.EBI
Bioorg Med Chem Lett 21: 1654-7 (2011)
Ligand Pharmaceuticals
1-((3S,4S)-4-amino-1-(4-substituted-1,3,5-triazin-2-yl) pyrrolidin-3-yl)-5,5-difluoropiperidin-2-one inhibitors of DPP-4 for the treatment of type 2 diabetes.EBI
Bioorg Med Chem Lett 21: 1810-4 (2011)
Pfizer
KDR inhibitor with the intramolecular non-bonded interaction: conformation-activity relationships of novel indole-3-carboxamide derivatives.EBI
Bioorg Med Chem Lett 21: 1782-5 (2011)
Santen Pharmaceutical
Efficient synthesis of triazole moiety-containing nucleotide analogs and their inhibitory effects on a malic enzyme.EBI
Bioorg Med Chem Lett 21: 1667-9 (2011)
Institute Of Chemical Physics
Isatin 1,2,3-triazoles as potent inhibitors against caspase-3.EBI
Bioorg Med Chem Lett 21: 1626-9 (2011)
University Of Oslo
Structure-activity relationship of 2,4,5-trioxoimidazolidines as inhibitors of thymidine phosphorylase.EBI
Eur J Med Chem 46: 1165-71 (2011)
University Of Manchester
Structure-based discovery of inhibitors of microsomal prostaglandin E2 synthase-1, 5-lipoxygenase and 5-lipoxygenase-activating protein: promising hits for the development of new anti-inflammatory agents.EBI
J Med Chem 54: 1565-75 (2011)
University Of Salerno
Cell-permeable and plasma-stable peptidomimetic inhibitors of the postsynaptic density-95/N-methyl-D-aspartate receptor interaction.EBI
J Med Chem 54: 1333-46 (2011)
University Of Copenhagen
Cysteine mapping in conformationally distinct kinase nucleotide binding sites: application to the design of selective covalent inhibitors.EBI
J Med Chem 54: 1347-55 (2011)
University Of Strasburg
Discovery of 9-(6-aminopyridin-3-yl)-1-(3-(trifluoromethyl)phenyl)benzo[h][1,6]naphthyridin-2(1H)-one (Torin2) as a potent, selective, and orally available mammalian target of rapamycin (mTOR) inhibitor for treatment of cancer.EBI
J Med Chem 54: 1473-80 (2011)
Dana-Farber Cancer Institute
Towards more specific O6-methylguanine-DNA methyltransferase (MGMT) inactivators.EBI
Bioorg Med Chem 19: 1658-65 (2011)
Trinity College
hNK2 receptor antagonists. The use of intramolecular hydrogen bonding to increase solubility and membrane permeability.EBI
Bioorg Med Chem Lett 21: 1807-9 (2011)
Menarini Ricerche
Synthesis and evaluation of [(1R)-1-amino-2-(2,5-difluorophenyl)ethyl]cyclohexanes and 4-[(1R)-1-amino-2-(2,5-difluorophenyl)ethyl]piperidines as DPP-4 inhibitors.EBI
Bioorg Med Chem Lett 21: 1880-6 (2011)
Merck Research Laboratories
Synthesis and SAR of sulfoxide substituted carboxyquinolines as NK3 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 1896-9 (2011)
Astrazeneca Pharmaceuticals
Non-nucleoside inhibitors of human adenosine kinase: synthesis, molecular modeling, and biological studies.EBI
J Med Chem 54: 1401-20 (2011)
Universita` Di Siena
Synthesis of 2-(substituted phenyl)-3,5,5-trimethylmorpholine analogues and their effects on monoamine uptake, nicotinic acetylcholine receptor function, and behavioral effects of nicotine.EBI
J Med Chem 54: 1441-8 (2011)
Research Triangle Institute
Natural compound cudraflavone B shows promising anti-inflammatory properties in vitro.EBI
J Nat Prod 74: 614-9 (2011)
University Of Veterinary And Pharmaceutical Sciences Brno
Design, synthesis, and biological activity of potent and orally available G protein-coupled receptor 40 agonists.EBI
J Med Chem 54: 1365-78 (2011)
Takeda Pharmaceutical
[I]-Celecoxib Analogues as SPECT Tracers of Cyclooxygenase-2 in Inflammation.EBI
ACS Med Chem Lett 2: 160-164 (2011)
TBA
17,20-lyase inhibitors. Part 4: design, synthesis and structure-activity relationships of naphthylmethylimidazole derivatives as novel 17,20-lyase inhibitors.EBI
Bioorg Med Chem 19: 1751-70 (2011)
Takeda Pharmaceutical
2-aminomethylphenylamine as a novel scaffold for factor Xa inhibitor.EBI
Bioorg Med Chem 19: 1623-42 (2011)
Daiichi Sankyo
Discovery of orally available tetrahydroquinoline-based glucocorticoid receptor agonists.EBI
Bioorg Med Chem Lett 21: 1697-700 (2011)
Ligand Pharmaceuticals
Discovery of potent and orally bioavailable heterocycle-based cannabinoid CB1 receptor agonists.EBI
Bioorg Med Chem Lett 21: 1748-53 (2011)
Merck Research Laboratories
Phellinstatin, a new inhibitor of enoyl-ACP reductase produced by the medicinal fungus Phellinus linteus.EBI
Bioorg Med Chem Lett 21: 1716-8 (2011)
Korea Research Institute Of Bioscience And Biotechnology
5-oxo-15-HETE: total synthesis and bioactivity.EBI
Bioorg Med Chem Lett 21: 1857-60 (2011)
Florida Institute Of Technology
Maintaining potent HTLV-I protease inhibition without the P3-cap moiety in small tetrapeptidic inhibitors.EBI
Bioorg Med Chem Lett 21: 1832-7 (2011)
Kyoto Pharmaceutical University
Synthesis, human monoamine oxidase inhibitory activity and molecular docking studies of 3-heteroarylcoumarin derivatives.EBI
Eur J Med Chem 46: 1147-52 (2011)
Universita Degli Studi Di Cagliari
Computer- and structure-based lead design for epigenetic targets.EBI
Bioorg Med Chem 19: 3605-15 (2011)
Martin-Luther University Of Halle-Wittenberg
Synthesis and evaluation of 1,5-diaryl-substituted tetrazoles as novel selective cyclooxygenase-2 (COX-2) inhibitors.EBI
Bioorg Med Chem Lett 21: 1823-6 (2011)
University Of Alberta
Design and synthesis of a novel, orally active, brain penetrant, tri-substituted thiophene based JNK inhibitor.EBI
Bioorg Med Chem Lett 21: 1838-43 (2011)
Elan Pharmaceuticals
Novel dihydrothieno[2,3-e]indazole derivatives as I&x3ba;B kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 1758-62 (2011)
Kyorin Pharmaceutical
4-aminopyrimidine-5-carbaldehyde oximes as potent VEGFR-2 inhibitors. Part II.EBI
Bioorg Med Chem Lett 21: 1815-8 (2011)
Johnson & Johnson Pharmaceutical Research & Development
Discovery and biological activity of a novel class I PI3K inhibitor, CH5132799.EBI
Bioorg Med Chem Lett 21: 1767-72 (2011)
Chugai Pharmaceutical
Discovery of a potent, orally bioavailable pyrimidine VLA-4 antagonist effective in a sheep asthma model.EBI
Bioorg Med Chem Lett 21: 1741-3 (2011)
Elan Pharmaceuticals
Pyridyl amides as potent inhibitors of T-type calcium channels.EBI
Bioorg Med Chem Lett 21: 1692-6 (2011)
Merck Research Laboratories
Oxindole derivatives as inhibitors of TAK1 kinase.EBI
Bioorg Med Chem Lett 21: 1724-7 (2011)
Myrexis
The synthesis and structure-activity relationship of pyridazinones as glucan synthase inhibitors.EBI
Bioorg Med Chem Lett 21: 1819-22 (2011)
Merck Research Laboratories
Thienopyrrole acetic acids as antagonists of the CRTH2 receptor.EBI
Bioorg Med Chem Lett 21: 1861-4 (2011)
Abbott Laboratories
Synthesis and SAR of novel quinazolines as potent and brain-penetrant c-jun N-terminal kinase (JNK) inhibitors.EBI
Bioorg Med Chem Lett 21: 1719-23 (2011)
The Scripps Research Institute
Design and synthesis of novel CCR2 antagonists: investigation of non-aryl/heteroaryl binding motifs.EBI
Bioorg Med Chem Lett 21: 1827-31 (2011)
Pfizer
Optimisation of ITK inhibitors through successive iterative design cycles.EBI
Bioorg Med Chem Lett 21: 1852-6 (2011)
Nycomed
Design and synthesis of novel allosteric MEK inhibitor CH4987655 as an orally available anticancer agent.EBI
Bioorg Med Chem Lett 21: 1795-801 (2011)
Chugai Pharmaceutical
Synthesis and biological activity of splitomicin analogs targeted at human NAD(+)-dependent histone deacetylases (sirtuins).EBI
Bioorg Med Chem 19: 3669-77 (2011)
Ernst-Moritz-Arndt University Greifswald
Discovery of benzimidazole pyrrolidinyl amides as prolylcarboxypeptidase inhibitors.EBI
Bioorg Med Chem Lett 21: 1299-305 (2011)
Merck Research Laboratories
Chroman and tetrahydroquinoline ureas as potent TRPV1 antagonists.EBI
Bioorg Med Chem Lett 21: 1338-41 (2011)
Abbott Laboratories
Synthesis and SAR of centrally active mGlu5 positive allosteric modulators based on an aryl acetylenic bicyclic lactam scaffold.EBI
Bioorg Med Chem Lett 21: 1350-3 (2011)
Vanderbilt Medical Center
Discovery of ((1S,3R)-1-isopropyl-3-((3S,4S)-3-methoxy-tetrahydro-2H-pyran-4-ylamino)cyclopentyl)(4-(5-(trifluoromethyl)pyridazin-3-yl)piperazin-1-yl)methanone, PF-4254196, a CCR2 antagonist with an improved cardiovascular profile.EBI
Bioorg Med Chem Lett 21: 2626-30 (2011)
Pfizer
Synthesis and biological evaluation of 2,5-disubstituted 1,3,4-oxadiazole derivatives with both COX and LOX inhibitory activity.BDB
J Enzyme Inhib Med Chem 26: 767-76 (2011)
Jamia Hamdard University
Design, synthesis, and biological evaluation of novel carbohydrate-based sulfamates as carbonic anhydrase inhibitors.EBI
J Med Chem 54: 1481-9 (2011)
Griffith University
Isoindolinone inhibitors of the murine double minute 2 (MDM2)-p53 protein-protein interaction: structure-activity studies leading to improved potency.EBI
J Med Chem 54: 1233-43 (2011)
Newcastle University
Discovery of TAK-733, a potent and selective MEK allosteric site inhibitor for the treatment of cancer.EBI
Bioorg Med Chem Lett 21: 1315-9 (2011)
Takeda California
Discovery of N-methyl-1-(1-phenylcyclohexyl)ethanamine, a novel triple serotonin, norepinephrine and dopamine reuptake inhibitor.EBI
Bioorg Med Chem Lett 21: 1434-7 (2011)
Sunovion Pharmaceuticals
Design and evaluation of a 2-(2,3,6-trifluorophenyl)acetamide derivative as an agonist of the GPR119 receptor.EBI
Bioorg Med Chem Lett 21: 1306-9 (2011)
Pfizer
Discovery of muscarinic acetylcholine receptor antagonist and beta 2 adrenoceptor agonist (MABA) dual pharmacology molecules.EBI
Bioorg Med Chem Lett 21: 1354-8 (2011)
Theravance
Discovery of N-methyl-1-(1-phenylcyclohexyl)methanamine, a novel triple serotonin, norepinephrine, and dopamine reuptake inhibitor.EBI
Bioorg Med Chem Lett 21: 1438-41 (2011)
Sunovion Pharmaceuticals
A novel class of dual mPGES-1/5-LO inhibitors based on thea-naphthyl pirinixic acid scaffold.EBI
Bioorg Med Chem Lett 21: 1329-33 (2011)
Goethe-University Frankfurt
After the grape rush: sirtuins as epigenetic drug targets in neurodegenerative disorders.EBI
Bioorg Med Chem 19: 3616-24 (2011)
Cemm-Research Center For Molecular Medicine Of The Austrian Academy Of Sciences
Simplification of the tetracyclic SIRT1-selective inhibitor MC2141: coumarin- and pyrimidine-based SIRT1/2 inhibitors with different selectivity profile.EBI
Bioorg Med Chem 19: 3659-68 (2011)
Sapienza University Of Rome
Synthesis and anti-migrative evaluation of moverastin derivatives.EBI
Bioorg Med Chem Lett 21: 1385-9 (2011)
Keio University
Investigation of a novel molecular descriptor for the lead optimization of 4-aminoquinazolines as vascular endothelial growth factor receptor-2 inhibitors: application for quantitative structure-activity relationship analysis in lead optimization.EBI
Bioorg Med Chem Lett 21: 1371-5 (2011)
Chaminade University Of Honolulu
Discovery ofß-aminoacyl containing thiazolidine derivatives as potent and selective dipeptidyl peptidase IV inhibitors.EBI
Bioorg Med Chem Lett 21: 1366-70 (2011)
Korea Research Institute Of Chemical Technology
Incorporation of a bioactive reverse-turn heterocycle into a peptide template using solid-phase synthesis to probe melanocortin receptor selectivity and ligand conformations by 2D 1H NMR.EBI
J Med Chem 54: 1379-90 (2011)
University Of Florida
Discovery of novel and potent orally active calcium-sensing receptor antagonists that stimulate pulselike parathyroid hormone secretion: synthesis and structure-activity relationships of tetrahydropyrazolopyrimidine derivatives.EBI
J Med Chem 54: 1430-40 (2011)
Takeda Pharmaceutical
Inhibitors of the oncogenic transcription factor AP-1 from Podocarpus latifolius.EBI
J Nat Prod 74: 374-7 (2011)
National Cancer Institute-Frederick
Simulation of multiple ion channel block provides improved early prediction of compounds' clinical torsadogenic risk.EBI
Cardiovasc Res 91: 53-61 (2011)
University Of Oxford
(R)-/(S)-10-camphorsulfonyl-substituted aromatic/heterocyclic sulfonamides selectively inhibit mitochondrial over cytosolic carbonic anhydrases.EBI
Bioorg Med Chem Lett 21: 1334-7 (2011)
Universit£
The design and synthesis of novel N-hydroxyformamide inhibitors of ADAM-TS4 for the treatment of osteoarthritis.EBI
Bioorg Med Chem Lett 21: 1376-81 (2011)
Astrazeneca
3,5-diarylazoles as novel and selective inhibitors of protein kinase D.EBI
Bioorg Med Chem Lett 21: 1447-51 (2011)
Novartis Institutes For Biomedical Research
Synthesis of 3-phenylpyrazolopyrimidine-1,2,3-triazole conjugates and evaluation of their Src kinase inhibitory and anticancer activities.EBI
Bioorg Med Chem Lett 21: 1342-6 (2011)
Institute Of Technology And Science
Anti-tumor pyrimidinylpiperazines bind to the prosurvival Bcl-2 protein family member Bcl-XL.EBI
Bioorg Med Chem Lett 21: 1325-8 (2011)
University Of The Pacific
Steroidal 5a-reductase inhibitors using 4-androstenedione as substrate.BDB
J Enzyme Inhib Med Chem 26: 712-9 (2011)
Metropolitan University-Xochimilco
Structure-activity relationships in nucleotide oligomerization domain 1 (Nod1) agonistic¿-glutamyldiaminopimelic acid derivatives.EBI
J Med Chem 54: 1490-510 (2011)
University Of Kansas
Design, synthesis and biological activity of pyrazolo[1,5-a]pyrimidin-7(4H)-ones as novel Kv7/KCNQ potassium channel activators.EBI
Eur J Med Chem 46: 934-43 (2011)
Hebei Medical University
Trisubstituted ureas as potent and selective mPGES-1 inhibitors.EBI
Bioorg Med Chem Lett 21: 1488-92 (2011)
Merck Frosst Center For Therapeutic Research
Design and synthesis of substituted N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamides as positive allosteric modulators of the metabotropic glutamate receptor subtype 5.EBI
Bioorg Med Chem Lett 21: 2650-4 (2011)
National Institute On Drug Abuse-Intramural Research Program
Synthesis of 9-substituted derivatives of berberine as anti-HIV agents.EBI
Eur J Med Chem 46: 1045-9 (2011)
National Institute Of Pharmaceutical Education And Research
a-D-mannose derivatives as models designed for selective inhibition of Golgia-mannosidase II.EBI
Eur J Med Chem 46: 944-52 (2011)
Slovak Academy Of Sciences
Synthesis and structure-activity relationship of N-(2-arylethyl) isoquinoline derivatives as human scavenger receptor CD36 antagonists.EBI
Eur J Med Chem 46: 1066-73 (2011)
Chinese Academy Of Medical Sciences And Peking Union Medical College
Design, synthesis and evaluation of 3-methylene-substituted indolinones as antimalarials.EBI
Eur J Med Chem 46: 927-33 (2011)
University Of Lisbon
Discovery of INCB10820/PF-4178903, a potent, selective, and orally bioavailable dual CCR2 and CCR5 antagonist.EBI
Bioorg Med Chem Lett 21: 1442-6 (2011)
Incyte
Structure-activity relationship studies of sphingosine-1-phosphate receptor agonists with N-cinnamyl-ß-alanine moiety.EBI
Bioorg Med Chem Lett 21: 1390-3 (2011)
Ono Pharmaceutical
Discovery and evaluation of pyrazolo[1,5-a]pyrimidines as neuropeptide Y1 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 2641-5 (2011)
Pfizer
A new structural alert for benzimidazoles: 2,6-dimethylphenyl substituents increase mutagenic potential and time-dependent CYP3A4 inhibition risk.EBI
Bioorg Med Chem Lett 21: 1422-4 (2011)
Global Discovery Chemistry
Design of novel CXCR4 antagonists that are potent inhibitors of T-tropic (X4) HIV-1 replication.EBI
Bioorg Med Chem Lett 21: 1414-8 (2011)
Genzyme
6-amino-4-(pyrimidin-4-yl)pyridones: novel glycogen synthase kinase-3ß inhibitors.EBI
Bioorg Med Chem Lett 21: 1429-33 (2011)
Pfizer
Discovery of novel positive allosteric modulators of the metabotropic glutamate receptor 5 (mGlu5).EBI
Bioorg Med Chem Lett 21: 1402-6 (2011)
Astrazeneca Pharmaceuticals
Design, synthesis and SAR of a series of 1,3,5-trisubstituted benzenes as thrombin inhibitors.EBI
Bioorg Med Chem Lett 21: 1536-40 (2011)
Merck Research Laboratories
P3 optimization of functional potency, in vivo efficacy and oral bioavailability in 3-aminopyrazinone thrombin inhibitors bearing non-charged groups at the P1 position.EBI
Bioorg Med Chem Lett 21: 1532-5 (2011)
Merck Research Laboratories
Potent agonists of the protease activated receptor 2 (PAR2).EBI
J Med Chem 54: 1308-13 (2011)
University Of Arizona
Amino-benzosuberone: a novel warhead for selective inhibition of human aminopeptidase-N/CD13.EBI
Bioorg Med Chem 19: 1434-49 (2011)
Merck Sharpe And Dohme
Identification of a new series of non-peptidic NK3 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 1498-501 (2011)
H. Lundbeck
Synthesis of N-alkylated noeurostegines and evaluation of their potential as treatment for Gaucher's disease.EBI
Bioorg Med Chem Lett 21: 1519-22 (2011)
Aarhus University
Reevaluation of the microsomal metabolism of montelukast: major contribution by CYP2C8 at clinically relevant concentrations.EBI
Drug Metab Dispos 39: 904-11 (2011)
University Of Helsinki
Metabolism and disposition of [14C]brivanib alaninate after oral administration to rats, monkeys, and humans.EBI
Drug Metab Dispos 39: 891-903 (2011)
Bristol-Myers Squibb
Structures of human Golgi-resident glutaminyl cyclase and its complexes with inhibitors reveal a large loop movement upon inhibitor binding.BDB
J Biol Chem 286: 12439-49 (2011)
Academia Sinica
Structure-activity relations on [1-(3,5-difluoro-4-hydroxyphenyl)-1H-pyrrol-3-yl]phenylmethanone. The effect of methoxy substitution on aldose reductase inhibitory activity and selectivity.EBI
Bioorg Med Chem 19: 1426-33 (2011)
Aristotle University Of Thessaloniki
Scaffold oriented synthesis. Part 4: design, synthesis and biological evaluation of novel 5-substituted indazoles as potent and selective kinase inhibitors employing heterocycle forming and multicomponent reactions.EBI
Bioorg Med Chem Lett 21: 1480-3 (2011)
Abbott Laboratories
Design, synthesis, pharmacological evaluation, and structure-activity study of novel endomorphin analogues with multiple structural modifications.EBI
J Med Chem 54: 1462-72 (2011)
Hungarian Academy Of Sciences
Discovery of New Human A(2A) Adenosine Receptor Agonists: Design, Synthesis, and Binding Mode of Truncated 2-Hexynyl-4'-thioadenosine.EBI
ACS Med Chem Lett 9: 516-520 (2010)
Ewha Womans University
Kinetic and docking studies of phenol-based inhibitors of carbonic anhydrase isoforms I, II, IX and XII evidence a new binding mode within the enzyme active site.EBI
Bioorg Med Chem 19: 1381-9 (2011)
University Of Calgary
Enhancement of pancreatic lipase inhibitory activity of curcumin by radiolytic transformation.EBI
Bioorg Med Chem Lett 21: 1512-4 (2011)
Daegu Haany University
Pyrrolo[1,2-f]triazines as JAK2 inhibitors: achieving potency and selectivity for JAK2 over JAK3.EBI
Bioorg Med Chem Lett 21: 1425-8 (2011)
Bristol-Myers Squibb
Scaffold oriented synthesis. Part 3: design, synthesis and biological evaluation of novel 5-substituted indazoles as potent and selective kinase inhibitors employing [2+3] cycloadditions.EBI
Bioorg Med Chem Lett 21: 1476-9 (2011)
Abbott Laboratories
Evolution of potent and stable placental-growth-factor-1-targeting CovX-bodies from phage display peptide discovery.EBI
J Med Chem 54: 1256-65 (2011)
Pfizer
N-cyclic bay-substituted perylene G-quadruplex ligands have selective antiproliferative effects on cancer cells and induce telomere damage.EBI
J Med Chem 54: 1140-56 (2011)
Sapienza University Of Rome
Biotin ergopeptide probes for dopamine receptors.EBI
J Med Chem 54: 1080-90 (2011)
University Of Barcelona
Ethanesulfohydroxamic acid ester prodrugs of nonsteroidal anti-inflammatory drugs (NSAIDs): synthesis, nitric oxide and nitroxyl release, cyclooxygenase inhibition, anti-inflammatory, and ulcerogenicity index studies.EBI
J Med Chem 54: 1356-64 (2011)
University Of Alberta
Acridone alkaloids as potent inhibitors of cathepsin V.EBI
Bioorg Med Chem 19: 1477-81 (2011)
Universidade Federal De S£O Carlos
Synthesis and SAR of 3-arylsulfonyl-pyrazolo[1,5-a]pyrimidines as potent serotonin 5-HT6 receptor antagonists.EBI
Bioorg Med Chem 19: 1482-91 (2011)
Chemical Diversity Research Institute
A QSAR study using MTD method and Dragon descriptors for a series of selective ligands ofa2C adrenoceptor.EBI
Eur J Med Chem 46: 877-84 (2011)
Timisoara Of The Romanian Academy
Discovery of substituted phenyl urea derivatives as novel long-actingß2-adrenoreceptor agonists.EBI
Bioorg Med Chem Lett 21: 1545-8 (2011)
RhôNe-Poulenc Rorer
Serendipitous discovery of a new class of agonists for the melanocortin 1 and 4 receptors and a new class of cyclophanes.EBI
Bioorg Med Chem Lett 21: 1459-63 (2011)
Novo Nordisk
Discovery of substituted 3-(phenylamino)benzoic acids as potent and selective inhibitors of type 5 17ß-hydroxysteroid dehydrogenase (AKR1C3).EBI
Bioorg Med Chem Lett 21: 1464-8 (2011)
University Of Pennsylvania
Synthesis of cell-permeable stapled peptide dual inhibitors of the p53-Mdm2/Mdmx interactions via photoinduced cycloaddition.EBI
Bioorg Med Chem Lett 21: 1472-5 (2011)
State University Of New York
Exploring subtype selectivity and metabolic stability of a novel series of ligands for the benzodiazepine binding site of the GABAA receptor.EBI
Bioorg Med Chem Lett 21: 1523-6 (2011)
Novartis Institutes For Biomedical Research
II. SAR studies of pyridyl-piperazinyl-piperidine derivatives as CXCR3 chemokine antagonists.EBI
Bioorg Med Chem Lett 21: 1527-31 (2011)
Ligand Pharmaceuticals
Tripeptide motifs in biology: targets for peptidomimetic design.EBI
J Med Chem 54: 1111-25 (2011)
Csiro Materials Science And Engineering
Synthesis and evaluation of 11C-labeled imidazo[2,1-b]benzothiazoles (IBTs) as PET tracers for imaging ?-amyloid plaques in Alzheimer's disease.EBI
J Med Chem 54: 949-56 (2011)
Technische Universit£T M£Nchen
Flavonoids from eight tropical plant species that inhibit the multidrug resistance transporter ABCG2.EBI
J Nat Prod 74: 262-6 (2011)
National Cancer Institute-Frederick
Reaction of the molybdenum- and copper-containing carbon monoxide dehydrogenase from Oligotropha carboxydovorans with quinones.BDB
Biochemistry 50: 1910-6 (2011)
University Of California Riverside
Development and evaluation of endothelin-A receptor (radio)ligands for positron emission tomography.EBI
J Med Chem 54: 939-48 (2011)
University Hospital Mu£Nster
Discovery of dual binding site acetylcholinesterase inhibitors identified by pharmacophore modeling and sequential virtual screening techniques.EBI
Bioorg Med Chem Lett 21: 1105-12 (2011)
National Institute Of Pharmaceutical Education And Research (Niper)
Aromatic ring functionalization of benzolactam derivatives: new potent dopamine D3 receptor ligands.EBI
Bioorg Med Chem Lett 21: 2670-4 (2011)
University Of Santiago De Compostela
6''-Azido-6''-deoxy-UDP-N-acetylglucosamine as a glycosyltransferase substrate.EBI
Bioorg Med Chem Lett 21: 1199-201 (2011)
University Of British Columbia
Identification and initial SAR of silybin: an Hsp90 inhibitor.EBI
Bioorg Med Chem Lett 21: 2659-64 (2011)
The University Of Kansas
Design and synthesis of potent Gram-negative specific LpxC inhibitors.EBI
Bioorg Med Chem Lett 21: 1155-61 (2011)
Merck Research Laboratories
Isosteric replacement of the Z-enone with haloethyl ketone and E-enone in a resorcylic acid lactone series and biological evaluation.EBI
Bioorg Med Chem Lett 21: 1167-70 (2011)
National University Of Ireland
Design of potent and selective GPR119 agonists for type II diabetes.EBI
Bioorg Med Chem Lett 21: 2665-9 (2011)
Merck
Virtual screening studies on HIV-1 reverse transcriptase inhibitors to design potent leads.EBI
Eur J Med Chem 46: 851-9 (2011)
Gvk Biosciences
Development of non-peptide ligands of growth factor receptor-bound protein 2-SRC homology 2 domain using molecular modeling and NMR spectroscopy.EBI
J Med Chem 54: 1096-100 (2011)
Universidad Complutense De Madrid
Combined X-ray, NMR, and kinetic analyses reveal uncommon binding characteristics of the hepatitis C virus NS3-NS4A protease inhibitor BI 201335.BDB
J Biol Chem 286: 11434-43 (2011)
Boehringer Ingelheim (Canada)
Indol-2-yl ethanones as novel indoleamine 2,3-dioxygenase (IDO) inhibitors.EBI
Bioorg Med Chem 19: 1550-61 (2011)
University Of Namur
Identification of small molecular inhibitors for Ero1p by structure-based virtual screening.EBI
Bioorg Med Chem Lett 21: 1118-21 (2011)
East China University Of Science And Technology
Design, synthesis, and in vivo characterization of a novel series of tetralin amino imidazoles as ?-secretase inhibitors: discovery of PF-3084014.EBI
Bioorg Med Chem Lett 21: 2637-40 (2011)
Pfizer
Quinazolines with intra-molecular hydrogen bonding scaffold (iMHBS) as PI3K/mTOR dual inhibitors.EBI
Bioorg Med Chem Lett 21: 1270-4 (2011)
Pfizer
Diamide amino-imidazoles: a novel series of ?-secretase inhibitors for the treatment of Alzheimer's disease.EBI
Bioorg Med Chem Lett 21: 2631-6 (2011)
Pfizer
Optimization of a novel class of benzimidazole-based farnesoid X receptor (FXR) agonists to improve physicochemical and ADME properties.EBI
Bioorg Med Chem Lett 21: 1134-40 (2011)
F. Hoffmann-La Roche
A chemotype that inhibits three unrelated pathogenic targets: the botulinum neurotoxin serotype A light chain, P. falciparum malaria, and the Ebola filovirus.EBI
J Med Chem 54: 1157-69 (2011)
University Of Belgrade
Bioactive compounds from the fern Lepisorus contortus.EBI
J Nat Prod 74: 129-36 (2011)
Yunnan Normal University
Discovery of a potent series of non-steroidal nona-trifluoromethyl carbinol glucocorticoid receptor agonists with reduced lipophilicity.EBI
Bioorg Med Chem Lett 21: 1126-33 (2011)
Glaxosmithkline
High concentration electrophysiology-based fragment screen: discovery of novel acid-sensing ion channel 3 (ASIC3) inhibitors.EBI
Bioorg Med Chem Lett 21: 2646-9 (2011)
Merck Research Laboratories
Benzyl benzoates: New phlorizin analogs as mushroom tyrosinase inhibitors.EBI
Bioorg Med Chem 19: 1167-71 (2011)
Sun Yat-Sen University
Furoxan nitric oxide donor coupled chrysin derivatives: synthesis and vasculoprotection.EBI
Bioorg Med Chem Lett 21: 1222-6 (2011)
Central South University
Synthesis of 6,14-epoxymorphinan derivatives and their pharmacologies.EBI
Bioorg Med Chem 19: 1205-21 (2011)
Kitasato University
Chemical and biological explorations of the electrophilic reactivity of the bioactive marine natural product halenaquinone with biomimetic nucleophiles.EBI
Bioorg Med Chem Lett 21: 1261-4 (2011)
University Of Auckland
Spirodiketopiperazine-based CCR5 antagonist: discovery of an antiretroviral drug candidate.EBI
Bioorg Med Chem Lett 21: 1141-5 (2011)
Ono Pharmaceutical
Structure and property based design, synthesis and biological evaluation of¿-lactam based HDAC inhibitors.EBI
Bioorg Med Chem Lett 21: 1218-21 (2011)
Yonsei University
Conformationally constrained farnesoid X receptor (FXR) agonists: heteroaryl replacements of the naphthalene.EBI
Bioorg Med Chem Lett 21: 1206-13 (2011)
Glaxosmithkline
A newß-carbonic anhydrase from Brucella suis, its cloning, characterization, and inhibition with sulfonamides and sulfamates, leading to impaired pathogen growth.EBI
Bioorg Med Chem 19: 1172-8 (2011)
University Of Montpellier
Optimisation of 6-substituted isoquinolin-1-amine based ROCK-I inhibitors.EBI
Bioorg Med Chem Lett 21: 1084-8 (2011)
Msd
A unique and rapid approach toward the efficient development of novel protein tyrosine phosphatase (PTP) inhibitors based on 'clicked' pseudo-glycopeptides.EBI
Bioorg Med Chem Lett 21: 1092-6 (2011)
East China University Of Science And Technology
Orally bioavailable imidazoazepanes as calcitonin gene-related peptide (CGRP) receptor antagonists: discovery of MK-2918.EBI
Bioorg Med Chem Lett 21: 2683-6 (2011)
Merck Research Laboratories
Potent and selective cyclohexyl-derived imidazopyrazine insulin-like growth factor 1 receptor inhibitors with in vivo efficacy.EBI
Bioorg Med Chem Lett 21: 1176-80 (2011)
Osi Pharmaceuticals
Non-oxime inhibitors of B-Raf(V600E) kinase.EBI
Bioorg Med Chem Lett 21: 1243-7 (2011)
Array Biopharma
Analysis ofß-amino alcohols as inhibitors of the potential anti-tubercular target N-acetyltransferase.EBI
Bioorg Med Chem Lett 21: 1185-90 (2011)
University Of Oxford
Synthesis and biological evaluation of novel N,N'-bis-methylenedioxybenzyl-alkylenediamines as bivalent anti-Alzheimer disease ligands.BDB
J Enzyme Inhib Med Chem 26: 706-11 (2011)
Sun Yat-Sen University
Synthesis, modification, and evaluation of (R)-de-O-methyllasiodiplodin and analogs as nonsteroidal antagonists of mineralocorticoid receptor.EBI
Bioorg Med Chem Lett 21: 1171-5 (2011)
Chinese Academy Of Sciences
Discovery, synthesis, and structure-activity relationship development of a series of N-(4-acetamido)phenylpicolinamides as positive allosteric modulators of metabotropic glutamate receptor 4 (mGlu(4)) with CNS exposure in rats.EBI
J Med Chem 54: 1106-10 (2011)
Vanderbilt University Medical Center
Probes for narcotic receptor mediated phenomena. 41. Unusual inverseµ-agonists and potentµ-opioid antagonists by modification of the N-substituent in enantiomeric 5-(3-hydroxyphenyl)morphans.EBI
J Med Chem 54: 957-69 (2011)
National Institute On Drug Abuse
Identification of Purine-Scaffold Small-Molecule Inhibitors of Stat3 Activation by QSAR Studies.EBI
ACS Med Chem Lett 2: 79-84 (2011)
TBA
Screening multicomponent reactions for X-linked inhibitor of apoptosis-baculoviral inhibitor of apoptosis protein repeats domain binder.EBI
J Med Chem 54: 890-900 (2012)
University Of Pittsburgh
Identification of curcumin derivatives as human glyoxalase I inhibitors: A combination of biological evaluation, molecular docking, 3D-QSAR and molecular dynamics simulation studies.EBI
Bioorg Med Chem 19: 1189-96 (2011)
Sun Yat-Sen University
Selective antagonists of mouse trace amine-associated receptor 1 (mTAAR1): discovery of EPPTB (RO5212773).EBI
Bioorg Med Chem Lett 21: 1227-31 (2011)
F. Hoffmann-La Roche
Synthesis and galectin-binding activities of mercaptododecyl glycosides containing a terminalß-galactosyl group.EBI
Bioorg Med Chem Lett 21: 1265-9 (2011)
National Institute Of Advanced Industrial Science And Technology (Aist)
Aminopyridinecarboxamide-based inhaled IKK-2 inhibitors for asthma and COPD: Structure-activity relationship.EBI
Bioorg Med Chem 19: 1242-55 (2011)
Pfizer
Enediol mimics as inhibitors of the D-arabinose 5-phosphate isomerase (KdsD) from Francisella tularensis.EBI
Bioorg Med Chem Lett 21: 2679-82 (2011)
University Of Michigan
Multitargeted drugs discovery: balancing anti-amyloid and anticholinesterase capacity in a single chemical entity.EBI
Bioorg Med Chem Lett 21: 2655-8 (2011)
Department Of Pharmaceutical Sciences-Alma Mater Studiorum-Bologna University
Structure-activity studies of a novel series of isoxazole-3-carboxamide derivatives as TRPV1 antagonists.EBI
Bioorg Med Chem Lett 21: 892-8 (2011)
Merck Sharpe And Dohme
Preparation and in vitro screening of symmetrical bis-isoquinolinium cholinesterase inhibitors bearing various connecting linkage--implications for early Myasthenia gravis treatment.EBI
Eur J Med Chem 46: 811-8 (2011)
University Of Defence
Synthesis and pharmacological activities of 6-glycine substituted 14-phenylpropoxymorphinans, a novel class of opioids with high opioid receptor affinities and antinociceptive potencies.EBI
J Med Chem 54: 980-8 (2011)
University Of Innsbruck
ATP-binding site of bacterial enzymes as a target for antibacterial drug design.EBI
J Med Chem 54: 915-29 (2011)
University Of Ljubljana
3-Thiomorpholin-8-oxo-8H-acenaphtho[1,2-b]pyrrole-9-carbonitrile (S1) based molecules as potent, dual inhibitors of B-cell lymphoma 2 (Bcl-2) and myeloid cell leukemia sequence 1 (Mcl-1): structure-based design and structure-activity relationship studies.EBI
J Med Chem 54: 1101-5 (2011)
Dalian University Of Technology
Pharmacophore models based studies on the affinity and selectivity toward 5-HT1A with reference to ?1-adrenergic receptors among arylpiperazine derivatives of phenytoin.EBI
Bioorg Med Chem 19: 1349-60 (2011)
Jagiellonian University Medical College
Probing the mid-gorge of cholinesterases with spacer-modified bivalent quinazolinimines leads to highly potent and selective butyrylcholinesterase inhibitors.EBI
Bioorg Med Chem 19: 1222-35 (2011)
Queen'S University Belfast
Difluoroethylamines as an amide isostere in inhibitors of cathepsin K.EBI
Bioorg Med Chem Lett 21: 920-3 (2011)
Merck Frosst Centre For Therapeutic Research
Influence of pKa on the biotransformation of indene H1-antihistamines by CYP2D6.EBI
Bioorg Med Chem Lett 21: 947-51 (2011)
Neurocrine Biosciences
New positive allosteric modulators of the metabotropic glutamate receptor 2 (mGluR2): identification and synthesis of N-propyl-8-chloro-6-substituted isoquinolones.EBI
Bioorg Med Chem Lett 21: 971-6 (2011)
Janssen-Cilag
Discovery of imidazo[1,2-b]pyridazines as IKKß inhibitors. Part 2: improvement of potency in vitro and in vivo.EBI
Bioorg Med Chem Lett 21: 904-8 (2011)
Daiichi Sankyo
Discovery and biological characterization of (2R,4S)-1'-acetyl-N-{(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl}-2-(4-fluoro-2-methylphenyl)-N-methyl-4,4'-bipiperidine-1-carboxamide as a new potent and selective neurokinin 1 (NK1) receptor antagonist clinical candidate.EBI
J Med Chem 54: 1071-9 (2011)
Glaxosmithkline
Analogues ofs receptor ligand 1-cyclohexyl-4-[3-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine (PB28) with added polar functionality and reduced lipophilicity for potential use as positron emission tomography radiotracers.EBI
J Med Chem 54: 1022-32 (2011)
Universita` Degli Studi Di Bari Aldo Moro
In vivo trypanosomicidal activity of imidazole- or pyrazole-based benzo[g]phthalazine derivatives against acute and chronic phases of Chagas disease.EBI
J Med Chem 54: 970-9 (2011)
Universidad De Granada
Design and synthesis of caffeoyl-anilides as portmanteau inhibitors of HIV-1 integrase and CCR5.EBI
Bioorg Med Chem 19: 1256-63 (2011)
National Institute Of Pharmaceutical Education And Research
Synthesis and biological activity of optically active NCL-1, a lysine-specific demethylase 1 selective inhibitor.EBI
Bioorg Med Chem 19: 3702-8 (2011)
Nagoya City University
Synthesis and serotonin transporter activity of 1,3-bis(aryl)-2-nitro-1-propenes as a new class of anticancer agents.EBI
Bioorg Med Chem 19: 1328-48 (2011)
Trinity College
1H-imidazo[4,5-c]pyridine-4-carbonitrile as cathepsin S inhibitors: separation of desired cellular activity from undesired tissue accumulation through optimization of basic nitrogen pka.EBI
Bioorg Med Chem Lett 21: 932-5 (2011)
Merck Research Laboratories
HIV-1 integrase strand-transfer inhibitors: design, synthesis and molecular modeling investigation.EBI
Eur J Med Chem 46: 756-64 (2011)
University Of Messina
X-ray crystal structure and binding mode analysis of human S-adenosylhomocysteine hydrolase complexed with novel mechanism-based inhibitors, haloneplanocin A analogues.EBI
J Med Chem 54: 930-8 (2011)
Ewha Womans University
Prenylated flavanones with anti-tyrosinase activity from Dalea boliviana.EBI
J Nat Prod 74: 158-62 (2011)
Universidad Nacional De Co£?Rdoba
Design, synthesis and SAR study of hydroxychalcone inhibitors of human ß-secretase (BACE1).BDB
J Enzyme Inhib Med Chem 26: 643-8 (2011)
Shanghai Institute Of Material Medica, Chinese Academy Of Sciences
Discovery of a 3-pyridylacetic acid derivative (TAK-100) as a potent, selective and orally active dipeptidyl peptidase IV (DPP-4) inhibitor.EBI
J Med Chem 54: 831-50 (2012)
Takeda Pharmaceutical
Identification of diaryl ether-based ligands for estrogen-related receptora as potential antidiabetic agents.EBI
J Med Chem 54: 788-808 (2012)
Johnson & Johnson Pharmaceutical Research And Development
Design, synthesis, and in vitro characterization of novel hybrid peptidomimetic inhibitors of STAT3 protein.EBI
Bioorg Med Chem 19: 1823-38 (2011)
University Of Toronto
DNA-dependent protein kinase (DNA-PK) inhibitors: structure-activity relationships for O-alkoxyphenylchromen-4-one probes of the ATP-binding domain.EBI
Bioorg Med Chem Lett 21: 966-70 (2011)
Newcastle University
Opioid bifunctional ligands from morphine and the opioid pharmacophore Dmt-Tic.EBI
Eur J Med Chem 46: 799-803 (2011)
University Of Cagliari
Preparation and evaluation of trisubstituted pyrimidines as phosphatidylinositol 3-kinase inhibitors. 3-Hydroxyphenol analogues and bioisosteric replacements.EBI
Bioorg Med Chem 19: 836-51 (2011)
The Institute Of Cancer Research
Inhibition of secreted phospholipases A2 by 2-oxoamides based ona-amino acids: Synthesis, in vitro evaluation and molecular docking calculations.EBI
Bioorg Med Chem 19: 735-43 (2011)
University Of Athens
(+)-Arisugacin A--computational evidence of a dual binding site covalent inhibitor of acetylcholinesterase.EBI
Bioorg Med Chem Lett 21: 2687-91 (2011)
Alchemical Research
Synthesis and structure-analgesic activity relationships of a novel series of monospirocyclopiperazinium salts (MSPZ).EBI
Bioorg Med Chem Lett 21: 940-3 (2011)
Peking University
Microwave-assisted synthesis of quinoline, isoquinoline, quinoxaline and quinazoline derivatives as CB2 receptor agonists.EBI
Bioorg Med Chem 19: 939-50 (2011)
University Of Eastern Finland
Mono-oxime bisquaternary acetylcholinesterase reactivators with prop-1,3-diyl linkage-Preparation, in vitro screening and molecular docking.EBI
Bioorg Med Chem 19: 754-62 (2011)
University Of Defence
Effect of structurally constrained oxime-ether linker on PPAR subtype selectivity: Discovery of a novel and potent series of PPAR-pan agonists.EBI
Bioorg Med Chem 19: 771-82 (2011)
Zydus Research Centre
Structure-based parallel medicinal chemistry approach to improve metabolic stability of benzopyran COX-2 inhibitors.EBI
Bioorg Med Chem Lett 21: 993-6 (2011)
Pfizer
Naphthalene/quinoline amides and sulfonylureas as potent and selective antagonists of the EP4 receptor.EBI
Bioorg Med Chem Lett 21: 1041-6 (2011)
Merck Frosst Centre For Therapeutic Research
Acylideneoxoindoles: a new class of reversible inhibitors of human transglutaminase 2.EBI
Bioorg Med Chem Lett 21: 2692-6 (2011)
Stanford University
Platensimycin and platencin congeners from Streptomyces platensis.EBI
J Nat Prod 74: 329-40 (2011)
Merck Research Laboratories
Natural and semisynthetic mammea-type isoprenylated dihydroxycoumarins uncouple cellular respiration.EBI
J Nat Prod 74: 240-8 (2011)
University Of Mississippi
Synthesis and Biological Evaluation of a New Series of 1,2,4-Triazolo[1,5-a]-1,3,5-triazines as Human A(2A) Adenosine Receptor Antagonists with Improved Water Solubility.EBI
J Med Chem 54: 877-89 (2011)
Universita Di Trieste
Design, synthesis and evaluation of novel tacrine-multialkoxybenzene hybrids as dual inhibitors for cholinesterases and amyloid beta aggregation.EBI
Bioorg Med Chem 19: 763-70 (2011)
Sun Yat-Sen University
17ß-HSD2 inhibitors for the treatment of osteoporosis: Identification of a promising scaffold.EBI
Bioorg Med Chem 19: 807-15 (2011)
Saarland University
Characterization and anions inhibition studies of ana-carbonic anhydrase from the teleost fish Dicentrarchus labrax.EBI
Bioorg Med Chem 19: 744-8 (2011)
Ondokuz Mayis University
1-(1-acetyl-piperidin-4-yl)-3-adamantan-1-yl-urea (AR9281) as a potent, selective, and orally available soluble epoxide hydrolase inhibitor with efficacy in rodent models of hypertension and dysglycemia.EBI
Bioorg Med Chem Lett 21: 983-8 (2011)
Ar£Te Therapeutics
The discovery of furo[2,3-c]pyridine-based indanone oximes as potent and selective B-Raf inhibitors.EBI
Bioorg Med Chem Lett 21: 1248-52 (2011)
Array Biopharma, 3200 Walnut Street, Boulder, Co 80301, Usa.
Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-methyl]-4'-(6-ethoxy-pyridin-3-yl)-6-methoxy-biphenyl-3-yl]-acetate (AM432): a potent, selective prostaglandin D2 receptor antagonist.EBI
Bioorg Med Chem Lett 21: 1036-40 (2011)
Amira Pharmaceuticals
Discovery of phosphoric acid mono-{2-[(E/Z)-4-(3,3-dimethyl-butyrylamino)-3,5-difluoro-benzoylimino]-thiazol-3-ylmethyl} ester (Lu AA47070): a phosphonooxymethylene prodrug of a potent and selective hA(2A) receptor antagonist.EBI
J Med Chem 54: 751-64 (2012)
H. Lundbeck
The identification of substituted benzothiophene derivatives as PGE(2) subtype 4 receptor antagonists: From acid to non-acid.EBI
Bioorg Med Chem Lett 21: 734-7 (2011)
Merck Frosst Centre For Therapeutic Research
Carbonic anhydrase inhibitors. Inhibition studies with anions and sulfonamides of a new cytosolic enzyme from the scleractinian coral Stylophora pistillata.EBI
Bioorg Med Chem Lett 21: 710-4 (2011)
Centre Scientifique De Monaco
Heteroarylimino-4-thiazolidinones as inhibitors of cartilage degradation.BDB
Bioorg Chem 39: 48-52 (2011)
University Of Catania
Syntheses of 2-amino and 2-halothiazole derivatives as high-affinity metabotropic glutamate receptor subtype 5 ligands and potential radioligands for in vivo imaging.EBI
J Med Chem 54: 901-8 (2012)
National Institute Of Mental Health
Deconstruction of non-nucleoside reverse transcriptase inhibitors of human immunodeficiency virus type 1 for exploration of the optimization landscape of fragments.EBI
J Med Chem 54: 709-18 (2011)
Beactica
Discovery of potent competitive antagonists and positive modulators of the P2X2 receptor.EBI
J Med Chem 54: 817-30 (2012)
University Of Bonn
A potent and selective indole N-type calcium channel (Ca(v)2.2) blocker for the treatment of pain.EBI
Bioorg Med Chem Lett 21: 869-73 (2011)
Merck Research Laboratories
Pyrimido[4,5-d]azepines as potent and selective 5-HT2C receptor agonists: design, synthesis, and evaluation of PF-3246799 as a treatment for urinary incontinence.EBI
Bioorg Med Chem Lett 21: 2715-20 (2011)
Pfizer
8-Aza-7,9-dideazaxanthine acyclic nucleoside phosphonate inhibitors of thymidine phosphorylase.EBI
Bioorg Med Chem Lett 21: 652-4 (2011)
Academy Of Sciences Of The Czech Republic
Discovery of fused 5,6-bicyclic heterocycles as ?-secretase modulators.EBI
Bioorg Med Chem Lett 21: 664-9 (2011)
Merck Research Laboratories
Design, synthesis and biological evaluation of novel L-lysine ureido derivatives as aminopeptidase N inhibitors.EBI
Bioorg Med Chem 19: 900-6 (2011)
Shandong University
Intramolecular azo-bridge as a cystine disulfide bond surrogate: Somatostatin-14 and brain natriuretic peptide (BNP) analogs.EBI
Bioorg Med Chem 19: 798-806 (2011)
The Weizmann Institute Of Science
Syntheses, structures and antibiotic activities of LpxC inhibitors based on the diacetylene scaffold.EBI
Bioorg Med Chem 19: 852-60 (2011)
Jilin University
Computational approach to the identification of novel Aurora-A inhibitors.EBI
Bioorg Med Chem 19: 907-16 (2011)
Korea Institute Of Science And Technology
Chromone 3-phenylcarboxamides as potent and selective MAO-B inhibitors.EBI
Bioorg Med Chem Lett 21: 707-9 (2011)
Universidade Do Porto
Biological study of a somatostatin mimetic based on the 1-deoxynojrimycin scaffold.EBI
Bioorg Med Chem Lett 21: 824-8 (2011)
Shandong University School Of Medicine
Discovery and optimization of a novel, selective and brain penetrant M1 positive allosteric modulator (PAM): the development of ML169, an MLPCN probe.EBI
Bioorg Med Chem Lett 21: 2697-701 (2011)
Vanderbilt Institute Of Chemical Biology/Chemical Synthesis Core
Design and synthesis of potent HIV-1 protease inhibitors incorporating hexahydrofuropyranol-derived high affinity P(2) ligands: structure-activity studies and biological evaluation.EBI
J Med Chem 54: 622-34 (2011)
Purdue University
Structural and biochemical study on the inhibitory activity of derivatives of 5-nitro-furan-2-carboxylic acid for RNase H function of HIV-1 reverse transcriptase.EBI
Bioorg Med Chem 19: 816-25 (2011)
Chiba University
Shp2 protein tyrosine phosphatase inhibitor activity of estramustine phosphate and its triterpenoid analogs.EBI
Bioorg Med Chem Lett 21: 730-3 (2011)
H. Lee Moffitt Cancer Center And Research Institute
Tetrahydroquinoline derivatives as opioid receptor antagonists.EBI
Bioorg Med Chem Lett 21: 670-6 (2011)
Glaxosmithkline
Exploration of SAR regarding glucose moiety in novel C-aryl glucoside inhibitors of SGLT2.EBI
Bioorg Med Chem Lett 21: 742-6 (2011)
Green Cross
A practical use of ligand efficiency indices out of the fragment-based approach: ligand efficiency-guided lead identification of soluble epoxide hydrolase inhibitors.EBI
J Med Chem 54: 851-7 (2012)
Dainippon Sumitomo Pharma
Discovery of novel phenylpyridone derivatives as potent and selective MCH1R antagonists.EBI
Bioorg Med Chem 19: 883-93 (2011)
Tsukuba Research Institute
Quinazolinones as¿-secretase modulators.EBI
Bioorg Med Chem Lett 21: 773-6 (2011)
Merck Research Laboratories
Structure based evolution of a novel series of positive modulators of the AMPA receptor.EBI
Bioorg Med Chem Lett 21: 805-11 (2011)
Merck Research Laboratories
2,4-Diaminopyrimidine inhibitors of c-Met kinase bearing benzoxazepine anilines.EBI
Bioorg Med Chem Lett 21: 660-3 (2011)
Cephalon
1-(Arylsulfonyl)-2,3-dihydro-1H-quinolin-4-one derivatives as 5-HT(6) serotonin receptor ligands.EBI
Bioorg Med Chem Lett 21: 698-703 (2011)
Korea Research Institute Of Chemical Technology
Inhibition of lymphoid tyrosine phosphatase by benzofuran salicylic acids.EBI
J Med Chem 54: 562-71 (2011)
Sanford-Burnham Medical Research Institute
Interaction potential of etravirine with drug transporters assessed in vitro.EBI
Antimicrob Agents Chemother 55: 1282-4 (2011)
University Hospital Heidelberg
Biotransformation of turmerones by Aspergillus niger.EBI
J Nat Prod 74: 86-9 (2011)
Kinki University
Synthesis and molecular modeling of novel tetrahydro-ß-carboline derivatives with phosphodiesterase 5 inhibitory and anticancer properties.EBI
J Med Chem 54: 495-509 (2011)
German University In Cairo
New drug-like hydroxyphenylnaphthol steroidomimetics as potent and selective 17ß-hydroxysteroid dehydrogenase type 1 inhibitors for the treatment of estrogen-dependent diseases.EBI
J Med Chem 54: 534-47 (2011)
Saarland University
Identifying chelators for metalloprotein inhibitors using a fragment-based approach.EBI
J Med Chem 54: 591-602 (2011)
University Of California
Solid-phase synthesis and biological evaluation of Joro spider toxin-4 from Nephila clavata.EBI
J Nat Prod 74: 483-6 (2011)
University Of Copenhagen
Design and synthesis of pyrimidinone and pyrimidinedione inhibitors of dipeptidyl peptidase IV.EBI
J Med Chem 54: 510-24 (2011)
Takeda California
Pyrimidine derivatives as potent and selective A3 adenosine receptor antagonists.EBI
J Med Chem 54: 457-71 (2011)
University Of Santiago De Compostela
Structure-based design of potent and selective 2-(quinazolin-2-yl)phenol inhibitors of checkpoint kinase 2.EBI
J Med Chem 54: 580-90 (2011)
The Institute Of Cancer Research
Discovery of a series of potent arylthiadiazole H(3) antagonists.EBI
Bioorg Med Chem Lett 21: 861-4 (2011)
Merck Research Laboratories
Azaindoles as potent CRTH2 receptor antagonists.EBI
Bioorg Med Chem Lett 21: 841-5 (2011)
Merck Frosst Centre For Therapeutic Research
Potent and selective thiophene urea-templated inhibitors of S6K.EBI
Bioorg Med Chem Lett 21: 849-52 (2011)
Pfizer
Predicting hERG activities of compounds from their 3D structures: development and evaluation of a global descriptors based QSAR model.EBI
Eur J Med Chem 46: 618-30 (2011)
Tcg Lifesciences
The synthesis and biological evaluation of 1-C-alkyl-L-arabinoiminofuranoses, a novel class ofa-glucosidase inhibitors.EBI
Bioorg Med Chem Lett 21: 738-41 (2011)
Tohoku Pharmaceutical University
The discovery of high affinity agonists of GPR109a with reduced serum shift and improved ADME properties.EBI
Bioorg Med Chem Lett 21: 2721-4 (2011)
Merck Research Laboratories
Molecular probes for the A2A adenosine receptor based on a pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine scaffold.EBI
Bioorg Med Chem Lett 21: 2740-5 (2011)
National Institute Of Diabetes And Digestive And Kidney Diseases
Design, synthesis, and pharmacological evaluation of azetedine and pyrrolidine derivatives as dual norepinephrine reuptake inhibitors and 5-HT(1A) partial agonists.EBI
Bioorg Med Chem Lett 21: 865-8 (2011)
Pfizer
Synthesis and SAR of 4-(pyrazol-3-yl)-pyridines as novel c-jun N-terminal kinase inhibitors.EBI
Bioorg Med Chem Lett 21: 2732-5 (2011)
The Scripps Research Institute
2-hydroxyisoquinoline-1,3(2H,4H)-diones as inhibitors of HIV-1 integrase and reverse transcriptase RNase H domain: influence of the alkylation of position 4.EBI
Eur J Med Chem 46: 535-46 (2011)
University Of Lille
Synthesis and evaluation ofß-carboline derivatives as potential monoamine oxidase inhibitors.EBI
Bioorg Med Chem 19: 134-44 (2011)
Facult£S Universitaires Notre-Dame De La Paix
Investigation ofa-phenylnorstatine anda-benzylnorstatine as transition state isostere motifs in the search for new BACE-1 inhibitors.EBI
Bioorg Med Chem 19: 145-55 (2011)
Uppsala University
Discovery of molecular switches within the ADX-47273 mGlu5 PAM scaffold that modulate modes of pharmacology to afford potent mGlu5 NAMs, PAMs and partial antagonists.EBI
Bioorg Med Chem Lett 21: 2711-4 (2011)
Vanderbilt University Medical Center
A novel transition state analog inhibitor of guanase based on azepinomycin ring structure: Synthesis and biochemical assessment of enzyme inhibition.EBI
Bioorg Med Chem Lett 21: 756-9 (2011)
TBA
Discovery of novel hepatoselective HMG-CoA reductase inhibitors for treating hypercholesterolemia: a bench-to-bedside case study on tissue selective drug distribution.EBI
Bioorg Med Chem Lett 21: 2725-31 (2011)
Pfizer
Three-dimensional quantitative structure-selectivity relationships analysis guided rational design of a highly selective ligand for the cannabinoid receptor 2.EBI
Eur J Med Chem 46: 547-55 (2011)
Universit£
Glucuronidation of the red clover isoflavone irilone by liver microsomes from different species and human UDP-glucuronosyltransferases.EBI
Drug Metab Dispos 39: 610-6 (2011)
Max Rubner-Institute
Novel pyrrolo[2,1-f][1,2,4]triazin-4-amines: Dual inhibitors of EGFR and HER2 protein tyrosine kinases.EBI
Bioorg Med Chem Lett 21: 781-5 (2011)
Bristol-Myers Squibb Research And Development
Interactions of monoamine oxidases with the antiepileptic drug zonisamide: specificity of inhibition and structure of the human monoamine oxidase B complex.EBI
J Med Chem 54: 909-12 (2012)
University Of Pavia
Discovery and SAR of 5-(3-chlorophenylamino)benzo[c][2,6]naphthyridine-8-carboxylic acid (CX-4945), the first clinical stage inhibitor of protein kinase CK2 for the treatment of cancer.EBI
J Med Chem 54: 635-54 (2011)
Cylene Pharmaceuticals
Radical scavenging and antioxidant activities of isocoumarins and a phthalide from the endophytic fungus Colletotrichum sp.EBI
J Nat Prod 74: 79-81 (2011)
Chulabhorn Institute
Synthesis and evaluation of 6-[1-(2-[(18)F]fluoro-3-pyridyl)-5-methyl-1H-1,2,3-triazol-4-yl]quinoline for positron emission tomography imaging of the metabotropic glutamate receptor type 1 in brain.EBI
Bioorg Med Chem 19: 102-10 (2011)
National Institute Of Radiological Sciences
Apixaban inhibition of factor Xa: Microscopic rate constants and inhibition mechanism in purified protein systems and in human plasma.BDB
J Enzyme Inhib Med Chem 26: 514-26 (2011)
Bristol-Myers Squibb
Comparative 3D QSAR study on ?(1)-, ?(2)-, and ?(3)-adrenoceptor agonists.EBI
Med Chem Res 19: 1121-1140 (2010)
National Institute Of Pharmaceutical Education And Research
Design, synthesis and biological evaluation of small molecule inhibitors of CD4-gp120 binding based on virtual screening.EBI
Bioorg Med Chem 19: 91-101 (2011)
Bryn Mawr College
Discovery of novel class 1 phosphatidylinositide 3-kinases (PI3K) fragment inhibitors through structure-based virtual screening.EBI
Bioorg Med Chem Lett 21: 829-35 (2011)
Astrazeneca R & D M£Lndal
Natural product-guided discovery of a fungal chitinase inhibitor.BDB
Chem Biol 17: 1275-81 (2010)
University Of Dundee
New furin inhibitors based on weakly basic amidinohydrazones.EBI
Bioorg Med Chem Lett 21: 836-40 (2011)
Philipps University Marburg
Synthesis of sugar-amino acid-nucleosides as potential glycosyltransferase inhibitors.EBI
Bioorg Med Chem 19: 58-66 (2011)
National Research Council Of Canada
DR396, an apoptotic DNase¿ inhibitor, attenuates high mobility group box 1 release from apoptotic cells.EBI
Bioorg Med Chem 19: 168-71 (2011)
Tokyo University Of Science
Structure-activity relationships of trans-substituted-propenoic acid derivatives on the nicotinic acid receptor HCA2 (GPR109A).EBI
Bioorg Med Chem Lett 21: 2736-9 (2011)
Leiden University
Design and synthesis of 3-pyridylacetamide derivatives as dipeptidyl peptidase IV (DPP-4) inhibitors targeting a bidentate interaction with Arg125.EBI
Bioorg Med Chem 19: 172-85 (2011)
Takeda Pharmaceutical
Triazoloquinazolinediones as novel high affinity ligands for the benzodiazepine site of GABA(A) receptors.EBI
Bioorg Med Chem 19: 111-21 (2011)
Lund University
Cholinergic and neuroprotective drugs for the treatment of Alzheimer and neuronal vascular diseases. II. Synthesis, biological assessment, and molecular modelling of new tacrine analogues from highly substituted 2-aminopyridine-3-carbonitriles.EBI
Bioorg Med Chem 19: 122-33 (2011)
Laboratorio De Radicales Libres Y Qu�Mica Computacional (Iqog, Csic)
Synthesis and xanthine oxidase inhibitory activity of 7-methyl-2-(phenoxymethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one derivatives.EBI
Bioorg Med Chem 19: 211-20 (2011)
University Of Mysore
Inhibition of theß-carbonic anhydrase from Streptococcus pneumoniae by inorganic anions and small molecules: Toward innovative drug design of antiinfectives?EBI
Bioorg Med Chem 19: 243-8 (2011)
Radboud University Nijmegen Medical Centre
QSAR of adenosine receptor antagonists: Exploring physicochemical requirements for binding of pyrazolo[4,3-e]-1,2,4-triazolo[1,5-c]pyrimidine derivatives with human adenosine A(3) receptor subtype.EBI
Bioorg Med Chem Lett 21: 818-23 (2011)
University Institute Of Pharmaceutical Sciences And Ugc Center Of Advanced Study In Pharmaceutical Sciences (Ugc-Cas)
New imidazoline/a(2)-adrenoceptors affecting compounds-4(5)-(2-aminoethyl)imidazoline (dihydrohistamine) derivatives. Synthesis and receptor affinity studies.EBI
Bioorg Med Chem 19: 156-67 (2011)
Gdansk University Of Technology
Novel tetrahydropyrido[3,2-c]pyrroles as 5-HT(7) antagonists.EBI
Bioorg Med Chem Lett 21: 42-4 (2010)
Johnson & Johnson Pharmaceutical Research And Development
Ursodeoxycholic acid amides as novel glucocorticoid receptor modulators.EBI
J Med Chem 54: 122-30 (2011)
Trinity College Dublin
Identification of a potent Janus kinase 3 inhibitor with high selectivity within the Janus kinase family.EBI
J Med Chem 54: 284-8 (2011)
Novartis Institutes For Biomedical Research
Design and synthesis of an orally active metabotropic glutamate receptor subtype-2 (mGluR2) positive allosteric modulator (PAM) that decreases cocaine self-administration in rats.EBI
J Med Chem 54: 342-53 (2011)
Sanford-Burnham Medical Research Institute
Casopitant: in vitro data and SimCyp simulation to predict in vivo metabolic interactions involving cytochrome P450 3A4.EBI
Drug Metab Dispos 39: 363-72 (2011)
Glaxosmithkline
Understanding DP receptor antagonism using a CoMSIA approach.EBI
Bioorg Med Chem Lett 21: 66-75 (2010)
Sanofi Aventis Us
Discovery of novel, potent, selective, and orally active human glucagon receptor antagonists containing a pyrazole core.EBI
Bioorg Med Chem Lett 21: 76-81 (2010)
Merck Research Laboratories
2-(4-carbonylphenyl)benzoxazole inhibitors of CETP: scaffold design and advancement in HDLc-raising efficacy.EBI
Bioorg Med Chem Lett 21: 1890-5 (2011)
Merck Research Laboratories
Novel bis-, tris-, and tetrakis-tertiary amino analogs as antagonists at neuronal nicotinic receptors that mediate nicotine-evoked dopamine release.EBI
Bioorg Med Chem Lett 21: 88-91 (2010)
University Of Kentucky
Trishomocubane as a scaffold for the development of selective dopamine transporter (DAT) ligands.EBI
Bioorg Med Chem Lett 21: 38-41 (2010)
The University Of Sydney
Novel serotonin type 3 receptor partial agonists for the potential treatment of irritable bowel syndrome.EBI
Bioorg Med Chem Lett 21: 58-61 (2010)
Amri
Peptide deformylase inhibitors with non-peptide scaffold: synthesis and structure-activity relationships.EBI
Bioorg Med Chem Lett 21: 133-6 (2010)
Seoul National University
Novel 6,7,8,9-tetrahydro-5H-1,4,7,10a-tetraaza-cyclohepta[f]indene analogues as potent and selective 5-HT(2C) agonists for the treatment of metabolic disorders.EBI
Bioorg Med Chem Lett 21: 34-7 (2010)
Evotec
The synthesis and biological evaluation of 2-(3-methyl or 3-phenylisoxazol-5-yl)-3-aryl-8-thiabicyclo[3.2.1]octanes.EBI
Bioorg Med Chem Lett 21: 48-51 (2010)
Organix
The characterization of a novel V1b antagonist lead series.EBI
Bioorg Med Chem Lett 21: 92-6 (2010)
Glaxosmithkline
Fragment-based discovery of 6-substituted isoquinolin-1-amine based ROCK-I inhibitors.EBI
Bioorg Med Chem Lett 21: 97-101 (2010)
Msd
Diphenylpropynone derivatives as probes for imagingß-amyloid plaques in Alzheimer's brains.EBI
Bioorg Med Chem Lett 21: 117-20 (2010)
Kyoto University
Application of p21 and klf2 reporter gene assays to identify selective histone deacetylase inhibitors for cancer therapy.EBI
Bioorg Med Chem Lett 21: 110-6 (2010)
Roche R & D Center China
Inhibition ofß-carbonic anhydrases with ureido-substituted benzenesulfonamides.EBI
Bioorg Med Chem Lett 21: 102-5 (2010)
Universit£
Design, synthesis, and testing of an 6-O-linked series of benzimidazole based inhibitors of CDK5/p25.EBI
Bioorg Med Chem 19: 359-73 (2011)
Duquesne University
Design of novel N-phenylnicotinamides as selective cyclooxygenase-1 inhibitors.EBI
Bioorg Med Chem Lett 21: 121-4 (2010)
Nanjing University
Preparation, in vitro screening and molecular modelling of symmetrical 4-tert-butylpyridinium cholinesterase inhibitors--analogues of SAD-128.EBI
Bioorg Med Chem Lett 21: 150-4 (2010)
University Of Defence
Potentiation of ribonuclease cytotoxicity by a poly(amidoamine) dendrimer.EBI
Bioorg Med Chem Lett 21: 2756-8 (2011)
University Of Wisconsin-Madison
Design, synthesis, and biological activity of thiazole derivatives as novel influenza neuraminidase inhibitors.BDB
J Enzyme Inhib Med Chem 26: 506-13 (2011)
Shandong University
Tuberatolides, potent FXR antagonists from the Korean marine tunicate Botryllus tuberatus.EBI
J Nat Prod 74: 90-4 (2011)
Seoul National University
Pipecolic acid derivatives as small-molecule inhibitors of the Legionella MIP protein.EBI
J Med Chem 54: 277-83 (2011)
University Of Wu£Rzburg
Synthesis and biological evaluation of 3-biphenyl-4-yl-4-phenyl-4H-1,2,4-triazoles as novel glycine transporter 1 inhibitors.EBI
J Med Chem 54: 387-91 (2011)
Astellas Pharma
Discovery of (7R)-14-cyclohexyl-7-{[2-(dimethylamino)ethyl](methyl) amino}-7,8-dihydro-6H-indolo[1,2-e][1,5]benzoxazocine-11-carboxylic acid (MK-3281), a potent and orally bioavailable finger-loop inhibitor of the hepatitis C virus NS5B polymerase.EBI
J Med Chem 54: 289-301 (2011)
P. Angeletti S.P.A. (Merck Research Laboratories)
Cytochrome P450 3A4 inhibitory constituents of the wood of Taxus yunnanensis.EBI
J Nat Prod 74: 102-5 (2011)
University Of Toyama
Investigations into the origin of the molecular recognition of several adenosine deaminase inhibitors.EBI
J Med Chem 54: 107-21 (2011)
Bar-Ilan University
Synthesis and biological evaluation of (6- and 7-phenyl) coumarin derivatives as selective nonsteroidal inhibitors of 17ß-hydroxysteroid dehydrogenase type 1.EBI
J Med Chem 54: 248-61 (2011)
University Of Ljubljana
Role of zinc in isoform-selective inhibitor binding to neuronal nitric oxide synthase .BDB
Biochemistry 49: 10803-10 (2010)
University Of California Irvine
Discovery of 5-chloro-N2-[(1S)-1-(5-fluoropyrimidin-2-yl)ethyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine (AZD1480) as a novel inhibitor of the Jak/Stat pathway.EBI
J Med Chem 54: 262-76 (2011)
Astrazeneca R&D
Benzopyrazine derivatives: A novel class of growth factor receptor bound protein 7 antagonists.EBI
Bioorg Med Chem 19: 693-701 (2011)
Monash University
Inhibition of monoamine oxidase by selected C5- and C6-substituted isatin analogues.EBI
Bioorg Med Chem 19: 261-74 (2011)
North-West University
Identification of novel ASK1 inhibitors using virtual screening.EBI
Bioorg Med Chem 19: 486-9 (2011)
Pharmadesign
Indole-3-piperazinyl derivatives: novel chemical class of 5-HT(6) receptor antagonists.EBI
Bioorg Med Chem Lett 21: 346-9 (2010)
Suven Life Sciences
Stereospecific synthesis and structure-activity relationships of unsymmetrical 4,4-diphenylbut-3-enyl derivatives of nipecotic acid as GAT-1 inhibitors.EBI
Bioorg Med Chem Lett 21: 602-5 (2010)
Glaxosmithkline
Discovery of novel and orally active FXR agonists for the potential treatment of dyslipidemia& diabetes.EBI
Bioorg Med Chem Lett 21: 191-4 (2010)
F. Hoffmann-La Roche
Evaluation of novel N1-methyl-2-phenylindol-3-ylglyoxylamides as a new chemotype of 18 kDa translocator protein-selective ligand suitable for the development of positron emission tomography radioligands.EBI
J Med Chem 54: 366-73 (2011)
National Institute Of Mental Health
Synthesis and biological evaluation of 7-substituted-1-(3-bromophenylamino)isoquinoline-4-carbonitriles as inhibitors of myosin light chain kinase and epidermal growth factor receptor.EBI
Bioorg Med Chem 19: 429-39 (2011)
Chemical Genomics Centre Of The Max Planck Society
Correlation analyses on binding affinity of substituted benzenesulfonamides with carbonic anhydrase using ab initio MO calculations on their complex structures (II).EBI
Bioorg Med Chem Lett 21: 141-4 (2010)
The University Of Tokushima Graduate School
Development of a new class of benzoylpyrrole-based PPARa/¿ activators.EBI
Bioorg Med Chem Lett 21: 220-4 (2010)
Dainippon Sumitomo Pharma
Azido-iodo-N-benzyl derivatives of threo-methylphenidate (Ritalin, Concerta): Rational design, synthesis, pharmacological evaluation, and dopamine transporter photoaffinity labeling.EBI
Bioorg Med Chem 19: 504-12 (2011)
Duquesne University Mylan School Of Pharmacy
3-[(Imidazolidin-2-yl)imino]indazole ligands with selectivity for thea(2)-adrenoceptor compared to the imidazoline I(1) receptor.EBI
Bioorg Med Chem 19: 321-9 (2011)
Medical University Of Gdansk
Vasorelaxant effect of flavonoids through calmodulin inhibition: Ex vivo, in vitro, and in silico approaches.EBI
Bioorg Med Chem 19: 542-6 (2011)
Universidad Aut£Noma Del Estado De Morelos
Small molecule inhibition of protein depalmitoylation as a new approach towards downregulation of oncogenic Ras signalling.EBI
Bioorg Med Chem 19: 1376-80 (2011)
Groningen Research Institute Of Pharmacy
Oxidative inactivation of the lymphoid tyrosine phosphatase mediated by both general and active site directed NO donors.EBI
Bioorg Med Chem Lett 21: 285-7 (2010)
University Of Utah
N-(Pyridin-3-yl)benzamides as selective inhibitors of human aldosterone synthase (CYP11B2).EBI
Bioorg Med Chem Lett 21: 186-90 (2010)
Saarland University & Helmholtz Institute For Pharmaceutical Research Saarland
Discovery and optimisation of a selective non-steroidal glucocorticoid receptor antagonist.EBI
Bioorg Med Chem Lett 21: 137-40 (2010)
Merck Research Laboratories
In vitro evaluation of 5-arylidene-2-thioxo-4-thiazolidinones active as aldose reductase inhibitors.EBI
Bioorg Med Chem Lett 21: 200-3 (2010)
University Of Messina
An imidazopiperidine series of CCR5 antagonists for the treatment of HIV: the discovery of N-{(1S)-1-(3-fluorophenyl)-3-[(3-endo)-3-(5-isobutyryl-2-methyl-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-1-yl)-8-azabicyclo[3.2.1]oct-8-yl]propyl}acetamide (PF-232798).EBI
J Med Chem 54: 67-77 (2011)
Pfizer
Aurora kinase inhibitors based on the imidazo[1,2-a]pyrazine core: fluorine and deuterium incorporation improve oral absorption and exposure.EBI
J Med Chem 54: 201-10 (2011)
Merck Research Laboratories
Phthalazinone pyrazoles as potent, selective, and orally bioavailable inhibitors of Aurora-A kinase.EBI
J Med Chem 54: 312-9 (2011)
Evotec (Uk)
Integration of lead optimization with crystallography for a membrane-bound ion channel target: discovery of a new class of AMPA receptor positive allosteric modulators.EBI
J Med Chem 54: 78-94 (2011)
University Of Sussex
Structural optimization of azadipeptide nitriles strongly increases association rates and allows the development of selective cathepsin inhibitors.EBI
J Med Chem 54: 396-400 (2011)
University Of Bonn
Design, synthesis, and structural analysis of phenylpropanoic acid-type PPAR¿-selective agonists: discovery of reversed stereochemistry-activity relationship.EBI
J Med Chem 54: 331-41 (2011)
Okayama University
Development of potent µ and d opioid agonists with high lipophilicity.EBI
J Med Chem 54: 382-6 (2011)
University Of Arizona
Design and optimization of benzimidazole-containing transient receptor potential melastatin 8 (TRPM8) antagonists.EBI
J Med Chem 54: 233-47 (2011)
Janssen Pharmaceutica
Discovery of novel N-ß-D-xylosylindole derivatives as sodium-dependent glucose cotransporter 2 (SGLT2) inhibitors for the management of hyperglycemia in diabetes.EBI
J Med Chem 54: 166-78 (2011)
Taiwan National Health Research Institutes
Synthesis, pharmacological activity and structure affinity relationships of spirocyclics(1) receptor ligands with a (2-fluoroethyl) residue in 3-position.EBI
Bioorg Med Chem 19: 393-405 (2011)
Institut F£R Pharmazeutische Und Medizinische Chemie Der Universit£T M£Nster
Facile synthesis and biological evaluation of 3,3-diphenylpropanoyl piperazines as T-type calcium channel blockers.EBI
Bioorg Med Chem Lett 21: 215-9 (2010)
Institute Of Science And Technology
A novel series of potent and selective EP(4) receptor ligands: facile modulation of agonism and antagonism.EBI
Bioorg Med Chem Lett 21: 484-7 (2010)
Merck Frosst Canada
3-(Pyridin-2-yl-ethynyl)benzamide metabotropic glutamate receptor 5 negative allosteric modulators: hit to lead studies.EBI
Bioorg Med Chem Lett 21: 195-9 (2010)
Pfizer
Eutypoids B-E produced by a Penicillium sp. strain from the North Sea.EBI
J Nat Prod 74: 99-101 (2011)
Institute Of Marine Sciences (Ifm-Geomar)
Novel trisubstituted benzimidazoles, targeting Mtb FtsZ, as a new class of antitubercular agents.EBI
J Med Chem 54: 374-81 (2011)
State University Of New York
Discovery of a series of phosphonic acid-containing thiazoles and orally bioavailable diamide prodrugs that lower glucose in diabetic animals through inhibition of fructose-1,6-bisphosphatase.EBI
J Med Chem 54: 153-65 (2011)
Metabasis Therapeutics
Reducing the brittleness of zein films through chemical modification.EBI
J Agric Food Chem 59: 56-61 (2011)
Rutgers University
Diabetes mellitus reduces activity of human UDP-glucuronosyltransferase 2B7 in liver and kidney leading to decreased formation of mycophenolic acid acyl-glucuronide metabolite.EBI
Drug Metab Dispos 39: 448-55 (2011)
University Of Rhode Island
Chalcones as novel influenza A (H1N1) neuraminidase inhibitors from Glycyrrhiza inflata.EBI
Bioorg Med Chem Lett 21: 294-8 (2011)
Chosun University
Efficient synthesis and biological evaluation of epiceanothic acid and related compounds.EBI
Bioorg Med Chem Lett 21: 338-41 (2010)
China Pharmaceutical University
Fused bicyclic derivatives of 2,4-diaminopyrimidine as c-Met inhibitors.EBI
Bioorg Med Chem Lett 21: 164-7 (2010)
Cephalon
Discovery of a small molecule PDI inhibitor that inhibits reduction of HIV-1 envelope glycoprotein gp120.BDB
ACS Chem Biol 6: 245-51 (2011)
Riken Advanced Science Institute
Synthesis of phosphatidylinositol 3-kinase (PI3K) inhibitory analogues of the sponge meroterpenoid liphagal.EBI
J Med Chem 53: 8523-33 (2010)
University Of British Columbia
Genetic and pharmacological inhibition of PDK1 in cancer cells: characterization of a selective allosteric kinase inhibitor.BDB
J Biol Chem 286: 6433-48 (2011)
Merck Research Laboratories
Modulating oxytocin activity and plasma stability by disulfide bond engineering.EBI
J Med Chem 53: 8585-96 (2010)
The University Of Queensland
Pharmacophore Refinement Guides the Rational Design of Nanomolar-Range Inhibitors of the Botulinum Neurotoxin Serotype A Metalloprotease.EBI
ACS Med Chem Lett 1: 301-305 (2010)
TBA
Discovery of Potent and Selective Inhibitors of Calcium-Dependent Protein Kinase 1 (CDPK1) from C. parvum and T. gondii.EBI
ACS Med Chem Lett 1: 331-335 (2011)
University Of Washington
Identification and characterization of novel inhibitors of mPTPB, an essential virulent phosphatase from Mycobacterium tuberculosis.EBI
ACS Med Chem Lett 1: 355-359 (2010)
Indiana University School Of Medicine
In Vitro antiretroviral properties of S/GSK1349572, a next-generation HIV integrase inhibitor.EBI
Antimicrob Agents Chemother 55: 813-21 (2011)
Shionogi
ApoA-I mimetic peptides promote pre-ß HDL formation in vivo causing remodeling of HDL and triglyceride accumulation at higher dose.EBI
Bioorg Med Chem 18: 8669-78 (2010)
Merck Research Laboratories
Biologically active constituents from the fruiting body of Taiwanofungus camphoratus.EBI
Bioorg Med Chem 19: 677-83 (2011)
National Formosa University
Synthesis and biological evaluation of new salvinorin A analogues incorporating natural amino acids.EBI
Bioorg Med Chem Lett 21: 160-3 (2010)
University Of Mississippi
Tetrahydroquinoline glucocorticoid receptor agonists: discovery of a 3-hydroxyl for improving receptor selectivity.EBI
Bioorg Med Chem Lett 21: 168-71 (2010)
Ligand Pharmaceuticals
Structure-activity relationships of 2,4-diphenyl-1H-imidazole analogs as CB2 receptor agonists for the treatment of chronic pain.EBI
Bioorg Med Chem Lett 21: 182-5 (2010)
Merck Research Laboratory
Synthesis and insecticidal activity of novel carbamate derivatives as potential dual-binding site acetylcholinesterase inhibitors.EBI
J Agric Food Chem 58: 12817-21 (2010)
Chinese Academy Of Agricultural Sciences
Specific Btk inhibition suppresses B cell- and myeloid cell-mediated arthritis.BDB
Nat Chem Biol 7: 41-50 (2011)
Cgi Pharmaceuticals
Highly selective c-Jun N-terminal kinase (JNK) 2 and 3 inhibitors with in vitro CNS-like pharmacokinetic properties prevent neurodegeneration.EBI
Bioorg Med Chem Lett 21: 315-9 (2010)
Elan Pharmaceuticals
Synthesis of a novel human PPARd selective agonist and its stimulatory effect on oligodendrocyte differentiation.EBI
Bioorg Med Chem Lett 21: 240-4 (2010)
Nippon Chemiphar
The identification, and optimisation of hERG selectivity, of a mixed NET/SERT re-uptake inhibitor for the treatment of pain.EBI
Bioorg Med Chem Lett 21: 271-5 (2010)
Msd
Design and synthesis of potent macrocyclic renin inhibitors.EBI
Bioorg Med Chem Lett 21: 358-62 (2010)
Medivir
Thiophene and bioisostere derivatives as new MMP12 inhibitors.EBI
Bioorg Med Chem Lett 21: 528-30 (2010)
Evotec Oai
Receptor activity and conformational analysis of 5'-halogenated resiniferatoxin analogs as TRPV1 ligands.EBI
Bioorg Med Chem Lett 21: 299-302 (2010)
Seoul National University
Silanetriols as in vitro inhibitors for AChE.EBI
Bioorg Med Chem Lett 21: 363-5 (2010)
Karl-Franzens-Universit£T Graz
Synthesis, biological assessment and molecular modeling of new dihydroquinoline-3-carboxamides and dihydroquinoline-3-carbohydrazide derivatives as cholinesterase inhibitors, and Ca channel antagonists.EBI
Eur J Med Chem 46: 1-10 (2010)
UniversitÉ
Preparation of triazole-linked glycosylated ??????-ketocarboxylic acid derivatives as new PTP1B inhibitors.BDB
Carbohydr Res 346: 140-5 (2011)
East China University Of Science And Technology
Reverse type I inhibitor of Mycobacterium tuberculosis CYP125A1.EBI
Bioorg Med Chem Lett 21: 332-7 (2011)
University Of California San Francisco
Structure-activity relationship (SAR) of thea-amino acid residue of potent tetrahydroisoquinoline (THIQ)-derived LFA-1/ICAM-1 antagonists.EBI
Bioorg Med Chem Lett 21: 307-10 (2010)
Sunesis Pharmaceuticals
Synthesis and SAR of novel CXCR4 antagonists that are potent inhibitors of T tropic (X4) HIV-1 replication.EBI
Bioorg Med Chem Lett 21: 262-6 (2010)
Genzyme
1,2,5-Oxadiazole analogues of leflunomide and related compounds.EBI
Eur J Med Chem 46: 383-92 (2010)
Universit£
Biological evaluation and structural determinants of p38α mitogen-activated-protein kinase and c-Jun-N-terminal kinase 3 inhibition by flavonoids.BDB
Chembiochem 11: 2579-88 (2010)
Eberhard Karls University Of Tuebingen
N-aryl-benzimidazolones as novel small molecule HSP90 inhibitors.EBI
Bioorg Med Chem Lett 20: 7503-6 (2010)
Abbott Laboratories
Discovery of a novel class of biphenyl pyrazole sodium channel blockers for treatment of neuropathic pain.EBI
Bioorg Med Chem Lett 20: 7479-82 (2010)
Merck Research Laboratories
Diamino-1,2,4-triazole derivatives are selective inhibitors of TYK2 and JAK1 over JAK2 and JAK3.EBI
Bioorg Med Chem Lett 20: 7454-7 (2010)
Sri International
Novel TNF-a converting enzyme (TACE) inhibitors as potential treatment for inflammatory diseases.EBI
Bioorg Med Chem Lett 20: 7283-7 (2010)
Merck Research Laboratories
Hypericins and thioredoxin reductase: Biochemical and docking studies disclose the molecular basis for effective inhibition by naphthodianthrones.EBI
Bioorg Med Chem 19: 631-41 (2011)
University Of Padova
Tubulin photoaffinity labeling study with a plinabulin chemical probe possessing a biotin tag at the oxazole.EBI
Bioorg Med Chem 19: 595-602 (2011)
Tokyo University Of Pharmacy And Life Sciences
Discovery of MK-7246, a selective CRTH2 antagonist for the treatment of respiratory diseases.EBI
Bioorg Med Chem Lett 21: 288-93 (2010)
Merck Frosst Centre For Therapeutic Research
Synthesis and biological evaluation of tubulysin D analogs related to stereoisomers of tubuvaline.EBI
Bioorg Med Chem Lett 21: 431-4 (2011)
Kyorin Pharmaceutical
Design, synthesis and pharmacobiological evaluation of novel acrylic acid derivatives acting as lipoxygenase and cyclooxygenase-1 inhibitors with antioxidant and anti-inflammatory activities.EBI
Eur J Med Chem 46: 191-200 (2010)
Aristotelian University Of Thessaloniki
The highly potent and selective dipeptidyl peptidase IV inhibitors bearing a thienopyrimidine scaffold effectively treat type 2 diabetes.EBI
Eur J Med Chem 46: 71-6 (2010)
Chinese Academy Of Sciences
Structure-activity relationships of substituted 1-pyridyl-2-phenyl-1,2-ethanediones: potent, selective carboxylesterase inhibitors.EBI
J Med Chem 53: 8709-15 (2010)
St. Jude Children'S Research Hospital
Chemical switch of a metabotropic glutamate receptor 2 silent allosteric modulator into dual metabotropic glutamate receptor 2/3 negative/positive allosteric modulators.EBI
J Med Chem 53: 8775-9 (2010)
Domain Therapeutics
Dipyrimidine amines: a novel class of chemokine receptor type 4 antagonists with high specificity.EBI
J Med Chem 53: 8556-68 (2010)
Emory University
Potential chemopreventive agents based on the structure of the lead compound 2-bromo-1-hydroxyphenazine, isolated from Streptomyces species, strain CNS284.EBI
J Med Chem 53: 8688-99 (2010)
Purdue University
Discovery of CP-690,550: a potent and selective Janus kinase (JAK) inhibitor for the treatment of autoimmune diseases and organ transplant rejection.EBI
J Med Chem 53: 8468-84 (2010)
Pfizer
Human cytochrome P450 liability studies of trans-dihydronarciclasine: a readily available, potent, and selective cancer cell growth inhibitor.EBI
J Nat Prod 74: 106-8 (2011)
Mcmaster University
Removal of the 26-methyl group from 19-nor-1a,25-dihydroxyvitamin D3 markedly reduces in vivo calcemic activity without altering in vitro VDR binding, HL-60 cell differentiation, and transcription.EBI
J Med Chem 53: 8642-9 (2010)
University Of Wisconsin-Madison
FimH antagonists for the oral treatment of urinary tract infections: from design and synthesis to in vitro and in vivo evaluation.EBI
J Med Chem 53: 8627-41 (2010)
University Of Basel
Discovery of 1-(3,4-dichlorophenyl)-N,N-dimethyl-1,2,3,4-tetrahydroquinolin-4-amine, a dual serotonin and dopamine reuptake inhibitor.EBI
Bioorg Med Chem Lett 21: 520-3 (2010)
Sunovion Pharmaceuticals
Synthesis and biological activity of novel 5'-arylamino-nucleosides by microwave-assisted one-pot tandem Staudinger/aza-Wittig/reduction.EBI
Bioorg Med Chem Lett 21: 574-6 (2011)
Hebei University
Discovery of pyrazolo[1,5-a]pyrimidine-based CHK1 inhibitors: a template-based approach--part 1.EBI
Bioorg Med Chem Lett 21: 467-70 (2010)
Merck Research Laboratories
Discovery of pyrazolo[1,5-a]pyrimidine-based CHK1 inhibitors: a template-based approach--part 2.EBI
Bioorg Med Chem Lett 21: 471-4 (2010)
Merck Research Laboratories
Discovery of isoindoline and tetrahydroisoquinoline derivatives as potent, selective PPARd agonists.EBI
Bioorg Med Chem Lett 21: 492-6 (2010)
Astrazeneca R&D Charnwood
2-Arylbenzoxazoles as CETP inhibitors: raising HDL-C in cynoCETP transgenic mice.EBI
Bioorg Med Chem Lett 21: 558-61 (2010)
Merck Research Laboratories
Discovery of a novel hybrid from finasteride and epristeride as 5a-reductase inhibitor.EBI
Bioorg Med Chem Lett 21: 475-8 (2010)
College Of Chemical And Environmental Engineering
Synthesis and pharmacological evaluation of 4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalenyl amines as triple reuptake inhibitors.EBI
Bioorg Med Chem 19: 663-76 (2011)
Sepracor
Identification of 3-sulfonylindazole derivatives as potent and selective 5-HT(6) antagonists.EBI
Bioorg Med Chem 19: 650-62 (2011)
Wyeth Research
Synthesis and 11ß hydroxysteroid dehydrogenase 1 inhibition of thiazolidine derivatives with an adamantyl group.EBI
Bioorg Med Chem Lett 21: 435-9 (2010)
Korea University
Synthesis and optimization of novel 4,4-disubstituted cyclohexylbenzamide derivatives as potent 11ß-HSD1 inhibitors.EBI
Bioorg Med Chem Lett 21: 405-10 (2010)
Amgen
Novel 4-aryl-pyrido[1,2-c]pyrimidines with dual SSRI and 5-HT(1A) activity. part 3.EBI
Eur J Med Chem 46: 142-9 (2010)
Medical University Of Warsaw
Novel isatinyl thiosemicarbazones derivatives as potential molecule to combat HIV-TB co-infection.EBI
Eur J Med Chem 46: 106-21 (2011)
Birla Institute Of Technology & Science-Pilani
Self-organizing molecular field analysis on humanß-secretase nonpeptide inhibitors: 5, 5-disubstituted aminohydantoins.EBI
Eur J Med Chem 46: 58-64 (2010)
Sichuan University
Molecular modeling studies on imidazo[4,5-b]pyridine derivatives as Aurora A kinase inhibitors using 3D-QSAR and docking approaches.EBI
Eur J Med Chem 46: 77-94 (2010)
Jinan University
Structure-based design, synthesis, and pharmacological evaluation of 3-(aminoalkyl)-5-fluoroindoles as myeloperoxidase inhibitors.EBI
J Med Chem 53: 8747-59 (2010)
Universite£? Libre De Bruxelles
Diadenosine 5',5''-(boranated)polyphosphonate analogues as selective nucleotide pyrophosphatase/phosphodiesterase inhibitors.EBI
J Med Chem 53: 8485-97 (2010)
Bar-Ilan University
Discovery of non-glycoside sodium-dependent glucose co-transporter 2 (SGLT2) inhibitors by ligand-based virtual screening.EBI
J Med Chem 53: 8770-4 (2010)
National Health Research Institutes
In silico discovery of acylated flavonol monorhamnosides from Eriobotrya japonica as natural, small-molecular weight inhibitors of XIAP BIR3.EBI
Bioorg Med Chem 19: 1002-9 (2011)
University Of Innsbruck
Synthesis and SAR study of new phenylimidazole-pyrazolo[1,5-c]quinazolines as potent phosphodiesterase 10A inhibitors.EBI
Bioorg Med Chem 19: 642-9 (2011)
Universit£
Imidazo[4,5-d]thiazolo[5,4-b]pyridine based inhibitors of IKK2: synthesis, SAR, PK/PD and activity in a preclinical model of rheumatoid arthritis.EBI
Bioorg Med Chem Lett 21: 383-6 (2010)
Bristol-Myers Squibb
Inhibition of lipoxygenase (LOX) and anticancer activity caused by gold(I) mixed ligands complexes of triphenylphosphine and thioamides.BDB
J Enzyme Inhib Med Chem 26: 592-7 (2011)
University Of Ioannina
Thermodynamic and NMR analysis of inhibitor binding to dihydrofolate reductase.EBI
Bioorg Med Chem 18: 8485-92 (2010)
York University
Click chemistry inspired one-pot synthesis of 1,4-disubstituted 1,2,3-triazoles and their Src kinase inhibitory activity.EBI
Bioorg Med Chem Lett 21: 449-52 (2010)
Institute Of Technology And Science
Identification and synthesis of novel inhibitors of acetyl-CoA carboxylase with in vitro and in vivo efficacy on fat oxidation.EBI
J Med Chem 53: 8679-87 (2010)
Sanofi-Aventis Deutschland
Discovery of novel GSK-3ß inhibitors with potent in vitro and in vivo activities and excellent brain permeability using combined ligand- and structure-based virtual screening.EBI
J Med Chem 53: 8534-45 (2010)
University Of Louisiana At Monroe
Analogues of 4-[(7-Bromo-2-methyl-4-oxo-3H-quinazolin-6-yl)methylprop-2-ynylamino]-N-(3-pyridylmethyl)benzamide (CB-30865) as potent inhibitors of nicotinamide phosphoribosyltransferase (Nampt).EBI
J Med Chem 53: 8734-46 (2010)
Myrexis
A novel pyrazolo[1,5-a]pyrimidine is a potent inhibitor of cyclin-dependent protein kinases 1, 2, and 9, which demonstrates antitumor effects in human tumor xenografts following oral administration.EBI
J Med Chem 53: 8508-22 (2010)
Imperial College
Discovery of 2-(6-{[(6-fluoroquinolin-2-yl)methyl]amino}bicyclo[3.1.0]hex-3-yl)-N-hydroxypyrimidine-5-carboxamide (CHR-3996), a class I selective orally active histone deacetylase inhibitor.EBI
J Med Chem 53: 8663-78 (2010)
Chroma Therapeutics
Catechin derivatives from Parapiptadenia rigida with in vitro wound-healing properties.EBI
J Nat Prod 73: 2035-41 (2010)
Albert-Ludwigs-University Of Freiburg
SIRT1 modulation as a novel approach to the treatment of diseases of aging.EBI
J Med Chem 54: 417-32 (2011)
Sirtris A Gsk
Novel chimeric histone deacetylase inhibitors: a series of lapatinib hybrides as potent inhibitors of epidermal growth factor receptor (EGFR), human epidermal growth factor receptor 2 (HER2), and histone deacetylase activity.EBI
J Med Chem 53: 8546-55 (2010)
University Of Regensburg
Ultrasensitive in situ visualization of active glucocerebrosidase molecules.BDB
Nat Chem Biol 6: 907-13 (2010)
Leiden University
Structure based optimization of chromen-based TNF-a converting enzyme (TACE) inhibitors on S1' pocket and their quantitative structure-activity relationship (QSAR) study.EBI
Bioorg Med Chem 18: 8618-29 (2010)
Yonsei University
Synthesis and pharmacological properties of novel hydrophilic 5-HT4 receptor antagonists.EBI
Bioorg Med Chem 18: 8600-13 (2010)
Drug Discovery Laboratory
Inhalation by design: dual pharmacology β-2 agonists/M3 antagonists for the treatment of COPD.EBI
Bioorg Med Chem Lett 21: 2759-63 (2011)
Pfizer
Synthesis, binding studies and molecular modeling of novel cannabinoid receptor ligands.EBI
Bioorg Med Chem 18: 8463-77 (2010)
German University In Cairo
Novel 2,3,4,5-tetrahydro-benzo[d]azepine derivatives of 2,4-diaminopyrimidine, selective and orally bioavailable ALK inhibitors with antitumor efficacy in ALCL mouse models.EBI
Bioorg Med Chem Lett 21: 463-6 (2010)
Cephalon
Discovery of NBI-77860/GSK561679, a potent corticotropin-releasing factor (CRF1) receptor antagonist with improved pharmacokinetic properties.EBI
Bioorg Med Chem Lett 20: 7259-64 (2010)
Neurocrine Biosciences
Design, synthesis, and structure-activity relationship study of bicyclic piperazine analogs of indole-3-carboxamides as novel cannabinoid CB1 receptor agonists.EBI
Bioorg Med Chem Lett 20: 7327-30 (2010)
Merck Research Laboratories
Selective peroxisome proliferator-activated receptord isosteric selenium agonists as potent anti-atherogenic agents in vivo.EBI
Bioorg Med Chem Lett 20: 7239-42 (2010)
Seoul National University
Discovery of new chemotype dipeptidyl peptidase IV inhibitors having (R)-3-amino-3-methyl piperidine as a pharmacophore.EBI
Bioorg Med Chem Lett 20: 7246-9 (2010)
Dainippon Sumitomo Pharma
The discovery and structure-activity relationships of indole-based inhibitors of glutamate carboxypeptidase II.EBI
Bioorg Med Chem Lett 20: 7222-5 (2010)
Eisai Research Institute
The identification of a series of novel, soluble non-peptidic neuropeptide Y Y2 receptor antagonists.EBI
Bioorg Med Chem Lett 20: 7341-4 (2010)
Glaxosmithkline
In silico identification and biochemical evaluation of novel inhibitors of NRH:quinone oxidoreductase 2 (NQO2).EBI
Bioorg Med Chem Lett 20: 7331-6 (2010)
University Of Manchester And Manchester Cancer Research Center
Design, synthesis and SAR of thienopyridines as potent CHK1 inhibitors.EBI
Bioorg Med Chem Lett 20: 7216-21 (2010)
Merck Research Laboratories
Receptor-dependent (RD) 3D-QSAR approach of a series of benzylpiperidine inhibitors of human acetylcholinesterase (HuAChE).EBI
Eur J Med Chem 46: 39-51 (2010)
Universidade Federal Do Rio De Janeiro (Ufrj)
Dimethyl-diphenyl-propanamide Derivatives As Nonsteroidal Dissociated Glucocorticoid Receptor Agonists.EBI
J Med Chem 53: 8241-51 (2010)
Bristol-Myers Squibb
Non-Natural Macrocyclic Inhibitors of Histone Deacetylases: Design, Synthesis, and ActivityEBI
J Med Chem 53: 8387-8399 (2010)
TBA
Brain tissue binding of drugs: evaluation and validation of solid supported porcine brain membrane vesicles (TRANSIL) as a novel high-throughput method.EBI
Drug Metab Dispos 39: 312-21 (2011)
Glaxosmithkline
Angiotensin II receptor type 1 (AT1) selective nonpeptidic antagonists--a perspective.EBI
Bioorg Med Chem 18: 8418-56 (2010)
The M. S. University Of Baroda
2-aminohydroxamic acid derivatives as inhibitors of Bacillus cereus phosphatidylcholine preferred phospholipase C PC-PLC(Bc).EBI
Bioorg Med Chem 18: 8549-55 (2010)
Institute Of Advance Chemistry Of Catalonia (Iqac-Csic)
Design and synthesis of disubstituted thiophene and thiazole based inhibitors of JNK.EBI
Bioorg Med Chem Lett 20: 7303-7 (2010)
Elan Pharmaceuticals
Synthesis and identification of new 4-arylidene curcumin analogues as potential anticancer agents targeting nuclear factor-?B signaling pathway.EBI
J Med Chem 53: 8260-73 (2010)
Sun Yat-Sen University
Incorporation of Piperazino Functionality into 1,3-Disubstituted Urea as the Tertiary Pharmacophore Affording Potent Inhibitors of Soluble Epoxide Hydrolase with Improved Pharmacokinetic PropertiesEBI
J Med Chem 53: 8376-8386 (2010)
TBA
Effect of tetracyclines on the dynamics of formation and destructuration of beta2-microglobulin amyloid fibrils.BDB
J Biol Chem 286: 2121-31 (2011)
University Of Pavia
Inactivation of cytochrome P450 (P450) 3A4 but not P450 3A5 by OSI-930, a thiophene-containing anticancer drug.EBI
Drug Metab Dispos 39: 345-50 (2011)
University Of Michigan
Discovery of 1H-benzo[d][1,2,3]triazol-1-yl 3,4,5-trimethoxybenzoate as a potential antiproliferative agent by inhibiting histone deacetylase.EBI
Bioorg Med Chem 18: 8457-62 (2010)
Nanjing University
7,8-disubstituted- but not 6,7-disubstituted coumarins selectively inhibit the transmembrane, tumor-associated carbonic anhydrase isoforms IX and XII over the cytosolic ones I and II in the low nanomolar/subnanomolar range.EBI
Bioorg Med Chem Lett 20: 7255-8 (2010)
Università
Discovery of new azaindole-based PI3Ka inhibitors: apoptotic and antiangiogenic effect on cancer cells.EBI
Bioorg Med Chem Lett 20: 7212-5 (2010)
Institute Of Science And Technology (Kaist)
4-aryl piperazine and piperidine amides as novel mGluR5 positive allosteric modulators.EBI
Bioorg Med Chem Lett 20: 7381-4 (2010)
Astrazeneca Pharmaceuticals
Bifunctional phenolic-choline conjugates as anti-oxidants and acetylcholinesterase inhibitors.BDB
J Enzyme Inhib Med Chem 26: 485-97 (2011)
Instituto Superior Técnico
Urease inhibitors from Indigofera gerardiana Wall.BDB
J Enzyme Inhib Med Chem 26: 480-4 (2011)
Khyber Medical College
Novel Helix-Constrained Nociceptin Derivatives Are Potent Agonists and Antagonists of ERK Phosphorylation and Thermal Analgesia in MiceEBI
J Med Chem 53: 8400-8408 (2010)
TBA
Biostructural and Pharmacological Studies of Bicyclic Analogues of the 3-Isoxazolol Glutamate Receptor Agonist Ibotenic AcidEBI
J Med Chem 53: 8354-8361 (2010)
TBA
Histamine H3 receptor as a drug discovery target.EBI
J Med Chem 54: 26-53 (2011)
TBA
Design, Synthesis, and Structure−Activity Relationships of 3-Ethynyl-1H-indazoles as Inhibitors of the Phosphatidylinositol 3-Kinase Signaling PathwayEBI
J Med Chem 53: 8368-8375 (2010)
TBA
Acetic Acid Derivatives of 3,4-Dihydro-2H-1,2,4-benzothiadiazine 1,1-Dioxide as a Novel Class of Potent Aldose Reductase InhibitorsEBI
J Med Chem 53: 8330-8344 (2010)
TBA
Cisplatin inhibits protein splicing, suggesting inteins as therapeutic targets in mycobacteria.BDB
J Biol Chem 286: 1277-82 (2011)
University Of Science And Technology Of China
Nicotinic Acetylcholine Receptor Efficacy and Pharmacological Properties of 3-(Substituted phenyl)-2ß-substituted Tropanes.EBI
J Med Chem 53: 8345-53 (2010)
Research Triangle Institute
Screening of selective inhibitors of 1a,25-dihydroxyvitamin D3 24-hydroxylase using recombinant human enzyme expressed in Escherichia coli.BDB
Biochemistry 49: 10403-11 (2010)
University Of Wisconsin
Benzobis(imidazolium)-cucurbit[8]uril complexes for binding and sensing aromatic compounds in aqueous solution.BDB
Chemistry 16: 13716-22 (2010)
University Of Cambridge
Synthesis and structure-activity relationship of tetrahydropyrazolopyrimidine derivatives--a novel structural class of potent calcium-sensing receptor antagonists.EBI
Bioorg Med Chem 18: 8501-11 (2010)
Takeda Pharmaceutical
A protected l-bromophosphonomethylphenylalanine amino acid derivative (BrPmp) for synthesis of irreversible protein tyrosine phosphatase inhibitors.EBI
Bioorg Med Chem 18: 8679-86 (2010)
University Of Alberta
Synthesis and pharmacological characterization of 5-phenyl-2-[2-(1-piperidinylcarbonyl)phenyl]-2,3-dihydro-1H-pyrrolo[1,2-c]imidazol-1-ones: a new class of Neuropeptide S antagonists.EBI
Bioorg Med Chem Lett 20: 7308-11 (2010)
Glaxosmithkline
Experimental solubility profiling of marketed CNS drugs, exploring solubility limit of CNS discovery candidate.EBI
Bioorg Med Chem Lett 20: 7312-6 (2010)
Astrazeneca
Discovery of N-benzyl-N'-(4-pipyridinyl)urea CCR5 antagonists as anti-HIV-1 agents (II): modification of the acyl portion.EBI
Bioorg Med Chem Lett 20: 7401-4 (2010)
Glaxosmithkline
Discovery of novel quinolinone adenosine A2B antagonists.EBI
Bioorg Med Chem Lett 20: 7414-20 (2010)
Ligand Pharmaceuticals
Synthesis and biological evaluation of 3-[4-(amino/methylsulfonyl)phenyl]methylene-indolin-2-one derivatives as novel COX-1/2 and 5-LOX inhibitors.EBI
Bioorg Med Chem Lett 20: 7349-53 (2010)
China Pharmaceutical University
Antiproliferative activity of phenylbutyrate ester of haloperidol metabolite II [(±)-MRJF4] in prostate cancer cells.EBI
Eur J Med Chem 46: 433-8 (2010)
University Of Catania
The novel benzopyran class of selective cyclooxygenase-2 inhibitors-part I: the first clinical candidate.EBI
Bioorg Med Chem Lett 20: 7155-8 (2010)
Pfizer
Effects of some drugs on human erythrocyte glucose 6-phosphate dehydrogenase: an in vitro study.BDB
J Enzyme Inhib Med Chem 25: 871-5 (2010)
Ataturk University
Discovery of 1-(3-{2-[4-(2-Methyl-5-quinolinyl)-1-piperazinyl]ethyl}phenyl)-2-imidazolidinone (GSK163090), a Potent, Selective, and Orally Active 5-HT1A/B/D Receptor AntagonistEBI
J Med Chem 53: 8228-8240 (2010)
TBA
Synthesis and pharmacological evaluation of the stereoisomers of 3-carba cyclic-phosphatidic acid.EBI
Bioorg Med Chem Lett 20: 7525-8 (2010)
University Of Tennessee Health Science Center
The identification of novel orally active mGluR5 antagonist GSK2210875.EBI
Bioorg Med Chem Lett 20: 7521-4 (2010)
Medicines Research Centre
Design and synthesis of an androgen receptor pure antagonist (CH5137291) for the treatment of castration-resistant prostate cancer.EBI
Bioorg Med Chem 18: 8150-7 (2010)
Chugai Pharmaceutical
Design, synthesis and inhibition activity of novel cyclic peptides against protein tyrosine phosphatase A from Mycobacterium tuberculosis.EBI
Bioorg Med Chem 18: 8365-73 (2010)
Institute Of Technology
Changes in flavonoid content and tyrosinase inhibitory activity in kenaf leaf extract after far-infrared treatment.EBI
Bioorg Med Chem Lett 20: 7534-6 (2010)
Amorepacific
Development of a sphingosine kinase 1 specific small-molecule inhibitor.EBI
Bioorg Med Chem Lett 20: 7498-502 (2010)
Pennsylvania State University College Of Medicine
2'-deoxy-2'-a-fluoro-2'-ß-C-methyl 3',5'-cyclic phosphate nucleotide prodrug analogs as inhibitors of HCV NS5B polymerase: discovery of PSI-352938.EBI
Bioorg Med Chem Lett 20: 7376-80 (2010)
Pharmasset
Disulfide cyclized tripeptide analogues of angiotensin IV as potent and selective inhibitors of insulin-regulated aminopeptidase (IRAP).EBI
J Med Chem 53: 8059-71 (2010)
Uppsala University
Virtual screening to identify novel antagonists for the G protein-coupled NK3 receptor.EBI
J Med Chem 53: 8080-8 (2010)
Northeastern Ohio Universities Colleges Of Medicine And Pharmacy
CYP4F enzymes are responsible for the elimination of fingolimod (FTY720), a novel treatment of relapsing multiple sclerosis.EBI
Drug Metab Dispos 39: 191-8 (2011)
Novartis Institutes For Biomedical Research
Acetazolamide-based fungal chitinase inhibitors.EBI
Bioorg Med Chem 18: 8334-40 (2010)
University Of Dundee
The discovery of tricyclic pyridone JAK2 inhibitors. Part 1: hit to lead.EBI
Bioorg Med Chem Lett 20: 7421-5 (2010)
Merck
Histamine H4 receptor agonists.EBI
Bioorg Med Chem Lett 20: 7191-9 (2010)
University Of Regensburg
Potent and selective 5-LO inhibitor bearing benzothiophene pharmacophore: discovery of MK-5286.EBI
Bioorg Med Chem Lett 20: 7440-3 (2010)
Merck Frosst Centre For Therapeutic Research
Comparative inhibitory activity of 3'- and 5'-functionalized nucleosides on ribonuclease A.EBI
Bioorg Med Chem 18: 8257-63 (2010)
Institute Of Technology
A novel ring-expanded product with enhanced tyrosinase inhibitory activity from classical Fe-catalyzed oxidation of rosmarinic acid, a potent antioxidative Lamiaceae polyphenol.EBI
Bioorg Med Chem Lett 20: 7393-6 (2010)
University Of Tokushima
Identification of potent and reversible cruzipain inhibitors for the treatment of Chagas disease.EBI
Bioorg Med Chem Lett 20: 7444-9 (2010)
Merck Research Laboratories
Design of a novel class of biphenyl CETP inhibitors.EBI
Bioorg Med Chem Lett 20: 7469-72 (2010)
Merck Sharp & Dohme
An alternative purification method for human serum paraoxonase 1 and its interactions with sulfonamides.BDB
Chem Biol Drug Des 76: 552-8 (2010)
AtatÜRk University
4-(Pyrazol-4-yl)-pyrimidines as selective inhibitors of cyclin-dependent kinase 4/6.EBI
J Med Chem 53: 7938-57 (2010)
Novartis Institutes For Biomedical Research
1,2,3-triazolyl amino acids as AMPA receptor ligands.EBI
Bioorg Med Chem Lett 20: 7512-5 (2010)
The University Of Adelaide
Potent and highly selective DP1 antagonists with 2,3,4,9-tetrahydro-1H-carbazole as pharmacophore.EBI
Bioorg Med Chem Lett 20: 7462-5 (2010)
Merck Frosst Centre For Therapeutic Research
Discovery of INCB3344, a potent, selective and orally bioavailable antagonist of human and murine CCR2.EBI
Bioorg Med Chem Lett 20: 7473-8 (2010)
Incyte
The discovery of new spirocyclic muscarinic M3 antagonists.EBI
Bioorg Med Chem Lett 20: 7458-61 (2010)
Astrazeneca
Azaindole N-methyl hydroxamic acids as HIV-1 integrase inhibitors-II. The impact of physicochemical properties on ADME and PK.EBI
Bioorg Med Chem Lett 20: 7429-34 (2010)
Pfizer
Synthesis of potent, substituted carbazoles as selective androgen receptor modulators (SARMs).EBI
Bioorg Med Chem Lett 20: 7516-20 (2010)
Radius Health
Inhibition of human neuraminidase 3 (NEU3) by C9-triazole derivatives of 2,3-didehydro-N-acetyl-neuraminic acid.EBI
Bioorg Med Chem Lett 20: 7529-33 (2010)
University Of Alberta
Discovery and characterization of 2-anilino-4- (thiazol-5-yl)pyrimidine transcriptional CDK inhibitors as anticancer agents.BDB
Chem Biol 17: 1111-21 (2010)
Cyclacel
Structural determinants of inhibitor selectivity in prokaryotic IMP dehydrogenases.BDB
Chem Biol 17: 1084-91 (2010)
Brandeis University
Design and synthesis of macrocyclic indoles targeting blood coagulation cascade Factor XIa.EBI
Bioorg Med Chem Lett 20: 6925-8 (2010)
Université
Discovery of N-benzyl-N'-(4-pipyridinyl)urea CCR5 antagonists as anti-HIV-1 agents (I): optimization of the amine portion.EBI
Bioorg Med Chem Lett 20: 7397-400 (2010)
Glaxosmithkline
5-amino-pyrazoles as potent and selective p38a inhibitors.EBI
Bioorg Med Chem Lett 20: 6886-9 (2010)
Bristol-Myers Squibb Research And Development
Discovery and selectivity-profiling of 4-benzylamino 1-aza-9-oxafluorene derivatives as lead structures for IGF-1R inhibitors.EBI
Bioorg Med Chem Lett 20: 6915-9 (2010)
Martin-Luther-University Halle-Wittenberg
Synthetic analogs of indole-containing natural products as inhibitors of sortase A and isocitrate lyase.EBI
Bioorg Med Chem Lett 20: 6882-5 (2010)
Institute
Identification and structure-activity relationship of 2-morpholino 6-(3-hydroxyphenyl) pyrimidines, a class of potent and selective PI3 kinase inhibitors.EBI
Bioorg Med Chem Lett 20: 6895-8 (2010)
Novartis Institutes For Biomedical Research
Electron density guided fragment-based lead discovery of ketohexokinase inhibitors.EBI
J Med Chem 53: 7979-91 (2010)
Johnson & Johnson Pharmaceutical Research And Development
Synthesis and biological evaluation of Apogossypolone derivatives as pan-active inhibitors of antiapoptotic B-cell lymphoma/leukemia-2 (Bcl-2) family proteins.EBI
J Med Chem 53: 8000-11 (2010)
Sanford-Burnham Medical Research Institute
Correlation between bilirubin glucuronidation and estradiol-3-gluronidation in the presence of model UDP-glucuronosyltransferase 1A1 substrates/inhibitors.EBI
Drug Metab Dispos 39: 322-9 (2011)
University Of Minnesota
1,3-Diphenyl-1H-pyrazole derivatives as a new series of potent PPAR¿ partial agonists.EBI
Bioorg Med Chem 18: 8315-23 (2010)
Sookmyung Women'S University
A novel small-molecule inhibitor of IL-6 signalling.EBI
Bioorg Med Chem Lett 20: 7029-32 (2010)
University Of London
Trifluoromethylphenyl as P2 for ketoamide-based cathepsin S inhibitors.EBI
Bioorg Med Chem Lett 20: 6890-4 (2010)
Merck Research Laboratories
Synthesis, biological evaluation and radiolabelling by 18F-fluoroarylation of a dopamine D3-selective ligand as prospective imaging probe for PET.EBI
Bioorg Med Chem Lett 20: 6933-7 (2010)
Friedrich-Alexander-UniversitäT Erlangen-NüRnberg
Spiroimidazolidinone NPC1L1 inhibitors. Part 2: structure-activity studies and in vivo efficacy.EBI
Bioorg Med Chem Lett 20: 6929-32 (2010)
Merck
Novel potent orally active multitargeted receptor tyrosine kinase inhibitors: synthesis, structure-activity relationships, and antitumor activities of 2-indolinone derivatives.EBI
J Med Chem 53: 8140-9 (2010)
Shanghai Hengrui Pharmaceuticals
Pulicatins A-E, neuroactive thiazoline metabolites from cone snail-associated bacteria.EBI
J Nat Prod 73: 1922-6 (2010)
University Of Utah
Side chain cyclization based on serine residues: synthesis, structure, and activity of a novel cyclic analogue of the parathyroid hormone fragment 1-11.EBI
J Med Chem 53: 8072-9 (2010)
University Of Padova

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EBI Curated by ChEMBL