The first public molecular recognition database, BindingDB supports research, education and practice in drug discovery, pharmacology and related fields.

BindingDB contains 3.2M data for 1.4M Compounds and 11.4K Targets. Of those, 1.6M data for 748K Compounds and 4.8K Targets were curated by BindingDB curators. BindingDB is a FAIRsharing resource.

If BindingDB was of value to your research, please take a moment to donate to this nonprofit project. Your donation will let us provide you with more data and improved service.

To help with training and testing AI and other models, BindingDB downloads and search results now provide the publication date and BindingDB curation date of each measurement.

219 articles for W Li


The following articles (labelled with PubMed ID or TBD) are for your review

PMID
Data
Article Title
Organization
Synthesis and evaluation of xanthine oxidase inhibitory and antioxidant activities of 2-arylbenzo[b]furan derivatives based on salvianolic acid C.EBI
China Pharmaceutical University
Synthesis, biological evaluation, QSAR and molecular dynamics simulation studies of potential fibroblast growth factor receptor 1 inhibitors for the treatment of gastric cancer.EBI
Wenzhou Medical Universtiy
Modulatory effects of silibinin in various cell signaling pathways against liver disorders and cancer - A comprehensive review.EBI
Tasly Pharmaceutical Group
Inhibitors for the bacterial ectonucleotidase Lp1NTPDase from Legionella pneumophila.EBI
University of Bonn
Synthesis and Biological Evaluation of Vitamin D3 Metabolite 20S,23S-Dihydroxyvitamin D3 and Its 23R Epimer.EBI
University of Tennessee Health Science Center
Discovery of Potent and Selective Agonists ofd Opioid Receptor by Revisiting the"Message-Address" Concept.EBI
Fudan University
Design, synthesis and evaluation of novel HIV-1 NNRTIs with dual structural conformations targeting the entrance channel of the NNRTI binding pocket.EBI
Shandong University
Structure-based design of N-substituted 1-hydroxy-4-sulfamoyl-2-naphthoates as selective inhibitors of the Mcl-1 oncoprotein.EBI
University of Maryland
Highly Substituted Cyclopentane-CMP Conjugates as Potent Sialyltransferase Inhibitors.EBI
Peking University
Chemical Synthesis and Biological Activities of 20S,24S/R-Dihydroxyvitamin D3 Epimers and Their 1a-Hydroxyl Derivatives.EBI
Veterans Affairs Medical Center
Soluble epoxide hydrolase inhibitory activity of anthraquinone components from Aloe.EBI
Chungnam National University
Discovery of new acetylcholinesterase inhibitors with small core structures through shape-based virtual screening.EBI
Nanjing University of Chinese Medicine
New Monocyclic, Bicyclic, and Tricyclic Ethynylcyanodienones as Activators of the Keap1/Nrf2/ARE Pathway and Inhibitors of Inducible Nitric Oxide Synthase.EBI
Stony Brook University
Discovery of Quinazoline-Based Fluorescent Probes toa1-Adrenergic Receptors.EBI
Shandong University
Design and synthesis of orally bioavailable aminopyrrolidinone histone deacetylase 6 inhibitors.EBI
Roche Innovation Center Shanghai
Canthinone alkaloids are novel protein tyrosine phosphatase 1B inhibitors.EBI
Toho University
Synthesis and evaluation of several oleanolic acid glycoconjugates as protein tyrosine phosphatase 1B inhibitors.EBI
North-West University
Biologically active triterpenoid saponins from Acanthopanax senticosus.EBI
Toho University
Synthesis and biological evaluation of 1,2,4-trisubstituted imidazoles as inhibitors of transforming growth factor-ß type I receptor (ALK5).EBI
Capital Normal University
Evaluation of licorice flavonoids as protein tyrosine phosphatase 1B inhibitors.EBI
Toho University
Discovery of MK-3168: A PET Tracer for Imaging Brain Fatty Acid Amide Hydrolase.EBI
Merck Research Laboratories
Synthesis and structure-activity relationship analysis of caffeic acid amides as selective matrix metalloproteinase inhibitors.EBI
Nanjing University of Chinese Medicine
A new target for an old drug: identifying mitoxantrone as a nanomolar inhibitor of PIM1 kinase via kinome-wide selectivity modeling.EBI
Peking Union Medical College
Discovery of new non-steroidal FXR ligands via a virtual screening workflow based on Phase shape and induced fit docking.EBI
East China University of Science and Technology
Prenylflavonoids from Glycyrrhiza uralensis and their protein tyrosine phosphatase-1B inhibitory activities.EBI
Toho University
Discovery of potent ligands for estrogen receptor beta by structure-based virtual screening.EBI
East China University of Science and Technology
2-Amino-5-benzoyl-4-phenylthiazoles: Development of potent and selective adenosine A1 receptor antagonists.EBI
University of Bonn
1-alkyl-8-(piperazine-1-sulfonyl)phenylxanthines: development and characterization of adenosine A2B receptor antagonists and a new radioligand with subnanomolar affinity and subtype specificity.EBI
Institute
Potent dual thymidylate synthase and dihydrofolate reductase inhibitors: classical and nonclassical 2-amino-4-oxo-5-arylthio-substituted-6-methylthieno[2,3-d]pyrimidine antifolates.EBI
Duquesne University
Pyrazolidine-3,5-dione derivatives as potent non-steroidal agonists of farnesoid X receptor: virtual screening, synthesis, and biological evaluation.EBI
Graduate School of The Chinese Academy of Sciences
Comparative metabolism of radiolabeled muraglitazar in animals and humans by quantitative and qualitative metabolite profiling.EBI
Bristol-Myers Squibb
Bis-(-)-nor-meptazinols as novel nanomolar cholinesterase inhibitors with high inhibitory potency on amyloid-beta aggregation.EBI
Fudan University
Synthesis of substituted 5[H]phenanthridin-6-ones as potent poly(ADP-ribose)polymerase-1 (PARP1) inhibitors.EBI
Guilford Pharmaceuticals
Discovery of potent and selective matrix metalloprotease 12 inhibitors for the potential treatment of chronic obstructive pulmonary disease (COPD).EBI
Pfizer
Discovery of 3-hydroxy-4-cyano-isoquinolines as novel, potent, and selective inhibitors of human 11ß-hydroxydehydrogenase 1 (11ß-HSD1).EBI
Bristol-Myers Squibb Research & Development
Synthesis and pharmacological evaluation of the stereoisomers of 3-carba cyclic-phosphatidic acid.EBI
University of Tennessee Health Science Center
Selective blockade of 2-arachidonoylglycerol hydrolysis produces cannabinoid behavioral effects.EBI
The Scripps Research Institute
Synthesis and anti-tumor activities of methyl 2-O-aryl-6-O-aryl'-D-glucopyranosides.EBI
Ocean University of China
Synthesis, in vitro structure-activity relationship, and in vivo studies of 2-arylthiazolidine-4-carboxylic acid amides as anticancer agents.EBI
University of Tennessee Health Science Center
Characterization of tunable piperidine and piperazine carbamates as inhibitors of endocannabinoid hydrolases.EBI
The Scripps Research Institute
Identification of a new class of small molecule C5a receptor antagonists.EBI
Wyeth Research
Highly selective and potent mu opioid ligands by unexpected substituent on morphine skeleton.EBI
Fudan University
3,4-Disubstituted benzofuran P1' MMP-13 inhibitors: optimization of selectivity and reduction of protein binding.EBI
Wyeth Research
Identification of an orally efficacious matrix metalloprotease 12 inhibitor for potential treatment of asthma.EBI
Wyeth Research
Discovery of betrixaban (PRT054021), N-(5-chloropyridin-2-yl)-2-(4-(N,N-dimethylcarbamimidoyl)benzamido)-5-methoxybenzamide, a highly potent, selective, and orally efficacious factor Xa inhibitor.EBI
Millennium Pharmaceuticals
Synthesis and biological evaluation of a series of liver-selective phosphonic acid thyroid hormone receptor agonists and their prodrugs.EBI
Metabasis Therapeutics
Design, synthesis and activity evaluation of quinolinone derivatives as EZH2 inhibitors.EBI
Southeast University
Reversal of subtype-selectivity and function by the introduction of a para-benzamidyl substituent to N-cyclopropylmethyl nornepenthone.EBI
Fudan University
Design, synthesis, activity and molecular dynamics studies of 1,3,4-thiadiazole derivatives as selective allosteric inhibitors of SHP2 for the treatment of cancer.EBI
Affiliated Hospital of Weifang Medical University
Preclinical Evaluation of Dihydropyrazole-Cored Positron Emission Tomography (PET) Ligands for Imaging of Receptor-Interacting Serine/Threonine Protein Kinase 1 (RIPK1) in the Brain.EBI
Beijing Normal University
Discovery of N'-benzyl-3-chloro-N-((1S,3R,4R)-3-((dimethylamino)methyl)-4-hydroxy-4-(3-methoxyphenyl)cyclohexyl)benzenesulfonamide as a novel selective KOR ligand.EBI
Fudan University
Identification of benzothiazoles as novel PCSK9 inhibitors.EBI
Hebei Normal University
Discovery of Novel Neo-Clerodane Derivatives as Potent Dual-Functional Antiosteoporosis Agents through Targeting Peroxisome Proliferator-Activated Receptor-γ.EBI
Sun Yat-sen University
Development of novel antivrial agents that induce the degradation of the main protease of human-infecting coronaviruses.EBI
Chinese Academy of Sciences
Discovery and preclinical evaluations of TQB3616, a novel CDK4-biased inhibitor.EBI
WuXi AppTec
Discovery of an Ortho-Substituted N-Cyclopropylmethyl-7α-phenyl-6,14-endoethano-tetrahydronorthebaine Derivative as a Selective and Potent Kappa Opioid Receptor Agonist with Subsided Sedative Effect.EBI
Fudan University
Discovery of Artemisinins as Microsomal Prostaglandins Synthase-2 Inhibitors for the Treatment of Colorectal Cancer via Chemoproteomics.EBI
Changshu Institute of Technology
Discovery of Novel Phenoxyaryl Pyridones as Bromodomain and Extra-Terminal Domain (BET) Inhibitors with High Selectivity for the Second Bromodomain (BD2) to Potentially Treat Acute Myeloid Leukemia.EBI
China Pharmaceutical University
Discovery of Pyrido[2,3-d]pyrimidin-7-one Derivatives as Highly Potent and Efficacious Ectonucleotide Pyrophosphatase/Phosphodiesterase 1 (ENPP1) Inhibitors for Cancer Treatment.EBI
Shanghai Institute of Materia Medica
Progress in the development of TRPV1 small-molecule antagonists: Novel Strategies for pain management.EBI
Hospital of Chengdu University of Traditional Chinese Medicine
Discovery of Oral AMP-Activated Protein Kinase Activators for Treating Hyperlipidemia.EBI
Chinese Academy of Medical Sciences and Peking Union Medical College
Butyrylcholinesterase-Activated Near-Infrared Fluorogenic Probe for In Vivo Theranostics of Alzheimer's Disease.EBI
China Pharmaceutical University
Plant-derived strategies to fight against severe acute respiratory syndrome coronavirus 2.EBI
Zhengzhou University
Design, synthesis, and biological evaluation of 5-(1H-indol-5-yl)isoxazole-3-carboxylic acids as novel xanthine oxidase inhibitors.EBI
Wuhan Institute of Technology
The mechanisms of multidrug resistance of breast cancer and research progress on related reversal agents.EBI
University of South China
Sokotrasterol Sulfate Suppresses IFN-γ-Induced PD-L1 Expression by Inhibiting JAK Activity.EBI
Fudan University
Design, Synthesis, and Antitumor Activity of Potent and Selective EGFR L858R/T790M Inhibitors and Identification of a Combination Therapy to Overcome Acquired Resistance in Models of Non-small-cell Lung Cancer.EBI
Sichuan University
Discovery of the First Raptor (Regulatory-Associated Protein of mTOR) Inhibitor as a New Type of Antiadipogenic Agent.EBI
Sun Yat-Sen University
Development and Pharmacochemical Characterization Discover a Novel Brain-Permeable HDAC11-Selective Inhibitor with Therapeutic Potential by Regulating Neuroinflammation in Mice.EBI
Sichuan University
Identification of a Novel, Potent, and Orally Bioavailable Guanidine-Based SHP2 Allosteric Inhibitor from Virtual Screening and Rational Structural Optimization for the Treatment of KRAS Mutant Cancers.EBI
China Pharmaceutical University
Structure-based discovery of novel α-aminoketone derivatives as dual p53-MDM2/MDMX inhibitors for the treatment of cancer.EBI
Nanjing University of Chinese Medicine
Discovery of a Series of Potent, Selective, and Orally Bioavailable Nucleoside Inhibitors of CD73 That Demonstrates EBI
Calithera Biosciences
Emerging targets and potential therapeutic agents in non-alcoholic fatty liver disease treatment.EBI
Sichuan University
Design, synthesis, and biological evaluation of acyl sulfonamide derivatives with spiro cycles as NaEBI
Fudan University
Design and Synthesis of Sulfonium Derivatives: A Novel Class of α-Glucosidase Inhibitors with Potent In Vivo Antihyperglycemic Activities.EBI
China Pharmaceutical University
Current approaches and strategies to identify Hedgehog signaling pathway inhibitors for cancer therapy.EBI
Peking Union Medical College
Discovery and optimization of 4-anilinoquinazoline derivatives spanning ATP binding site and allosteric site as effective EGFR-C797S inhibitors.EBI
East China University of Science and Technology
Design, synthesis and anticancer evaluation of 3-methyl-1H-indazole derivatives as novel selective bromodomain-containing protein 4 inhibitors.EBI
China Pharmaceutical University
Therapeutic potential of targeting α/β-Hydrolase domain-containing 6 (ABHD6).EBI
Sichuan University
Activity-based protein profiling: Recent advances in medicinal chemistry.EBI
Sichuan University
Strategies for Structural Modification of Small Molecules to Improve Blood-Brain Barrier Penetration: A Recent Perspective.EBI
China Pharmaceutical University
Discovery, Structure-Activity Relationship, and Mechanistic Studies of 1-((3EBI
Fudan University
Recent Progress on Tubulin Inhibitors with Dual Targeting Capabilities for Cancer Therapy.EBI
National Clinical Research Center For Geriatrics
Discovery of Proline-Based p300/CBP Inhibitors Using DNA-Encoded Library Technology in Combination with High-Throughput Screening.EBI
Glaxosmithkline
Discovery of 1,6-Naphthyridin-2(1EBI
Nanjing University of Chinese Medicine
Discovery of a Novel Src Homology-2 Domain Containing Protein Tyrosine Phosphatase-2 (SHP2) and Cyclin-Dependent Kinase 4 (CDK4) Dual Inhibitor for the Treatment of Triple-Negative Breast Cancer.EBI
China Pharmaceutical University
Discovery of novel dual RAGE/SERT inhibitors for the potential treatment of the comorbidity of Alzheimer's disease and depression.EBI
East China University of Science and Technology
Novel inhibitors of AChE and Aβ aggregation with neuroprotective properties as lead compounds for the treatment of Alzheimer's disease.EBI
China Pharmaceutical University
-Benzyl Benzamide Derivatives as Selective Sub-Nanomolar Butyrylcholinesterase Inhibitors for Possible Treatment in Advanced Alzheimer's Disease.EBI
China Pharmaceutical University
Is a Highly Selective and Potent κ Opioid Receptor (KOR) Agonist with an Unexpected Nonreduction in Locomotor Activity.EBI
Fudan University
Synthesis and SAR of highly selective MMP-13 inhibitors.EBI
Wyeth Research
Design, Synthesis, and Biological Evaluation of Pyrrole-2-carboxamide Derivatives as Mycobacterial Membrane Protein Large 3 Inhibitors for Treating Drug-Resistant Tuberculosis.EBI
Peking Union Medical College and Chinese Academy of Medical Sciences
Discovery of non-substrate, environmentally sensitive turn-on fluorescent probes for imaging HDAC8 in tumor cells and tissue slices.EBI
Nanjing University of Chinese Medicine
Hybrid Diterpenic Meroterpenoids from an Endophytic EBI
Kunming Medical University
Discovery of 2,5-diphenyl-1,3,4-thiadiazole derivatives as HDAC inhibitors with DNA binding affinity.EBI
Qilu University of Technology (Shandong Academy of Sciences)
The discovery of orally active triaminotriazine aniline amides as inhibitors of p38 MAP kinase.EBI
Bristol-Myers Squibb
Discovery of Pteridine-7(8EBI
East China University of Science and Technology
Dynamics-Based Discovery of Novel, Potent Benzoic Acid Derivatives as Orally Bioavailable Selective Estrogen Receptor Degraders for ERα+ Breast Cancer.EBI
Nanjing University of Chinese Medicine
Design and Synthesis of Oleanolic Acid Trimers to Enhance Inhibition of Influenza Virus Entry.EBI
Medical School of Kunming University of Science and Technology
Structure-activity relationship investigation for imidazopyrazole-3-carboxamide derivatives as novel selective inhibitors of Bruton's tyrosine kinase.EBI
Henan Normal University
Discovery of 1-Amino-1EBI
Henan Normal University
Discovery of an EBI
Fudan University
N,N-Dialkylated 4-(4-arylsulfonylpiperazine-1-carbonyl)-benzamidines and 4-((4-arylsulfonyl)-2-oxo-piperazin-1-ylmethyl)-benzamidines as potent factor Xa inhibitors.EBI
Millennium Pharmaceuticals
Design of Dimeric Bile Acid Derivatives as Potent and Selective Human NTCP Inhibitors.EBI
National Institute of Biological Sciences
Synthesis and biological evaluation of selective survivin inhibitors derived from the MX-106 hydroxyquinoline scaffold.EBI
University of Tennessee Health Science Center
The synthesis and bioactivity of pyrrolo[2,3-d]pyrimidine derivatives as tyrosine kinase inhibitors for NSCLC cells with EGFR mutations.EBI
Sichuan University
Synthesis and biological evaluation of thiol-based inhibitors of glutamate carboxypeptidase II: discovery of an orally active GCP II inhibitor.EBI
Guilford Pharmaceuticals
An in silico mechanistic insight into HDAC8 activation facilitates the discovery of new small-molecule activators.EBI
Shandong University
Discovery of a Highly Selective and Potent TRPC3 Inhibitor with High Metabolic Stability and Low Toxicity.EBI
The University of Tennessee Health Science Center
Potent and Specific Inhibition of NTCP-Mediated HBV/HDV Infection and Substrate Transporting by a Novel, Oral-Available Cyclosporine A Analogue.EBI
National Institute of Biological Sciences
Substituted acrylamides as factor Xa inhibitors: improving bioavailability by P1 modification.EBI
Millennium Pharmaceuticals
Discovery of 4-amino-1H-pyrazolo[3,4-d]pyrimidin derivatives as novel discoidin domain receptor 1 (DDR1) inhibitors.EBI
China Pharmaceutical University
Design, synthesis, and SAR of substituted acrylamides as factor Xa inhibitors.EBI
Millennium Pharmaceuticals
Design, synthesis and evaluation of 1-benzyl-1H-imidazole-5-carboxamide derivatives as potent TGR5 agonists.EBI
Henan University
Novel indolylarylsulfone derivatives as covalent HIV-1 reverse transcriptase inhibitors specifically targeting the drug-resistant mutant Y181C.EBI
Shandong University
Discovery of aryl-piperidine derivatives as potential antipsychotic agents using molecular hybridization strategy.EBI
Fudan University
Discovery of 3-((dimethylamino)methyl)-4-hydroxy-4-(3-methoxyphenyl)-N-phenylpiperidine-1-carboxamide as novel potent analgesic.EBI
Fudan University
Design and pharmacological activity of phosphinic acid based NAALADase inhibitors.EBI
Guilford Pharmaceuticals
Fragment-based modification of 2,4-diarylaminopyrimidine derivatives as ALK and ROS1 dual inhibitors to overcome secondary mutants.EBI
Shenyang Pharmaceutical University
Design and synthesis of potent PAR-1 antagonists based on vorapaxar.EBI
Hebei University of Technology
Design, synthesis and biological activity evaluation of novel 4-((1-cyclopropyl-3-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-4-yl) oxy) pyridine-2-yl) amino derivatives as potent transforming growth factor-β (TGF-β) type I receptor inhibitors.EBI
China Pharmaceutical University
Discovery of 5-(4-methylpiperazin-1-yl)-2-nitroaniline derivatives as a new class of SIRT6 inhibitors.EBI
Sichuan University
Acyl substitution at the ortho position of anilides enhances oral bioavailability of thiophene sulfonamides: TBC3214, an ETA selective endothelin antagonist.EBI
Texas Biotechnology
An overview of Sirtuins as potential therapeutic target: Structure, function and modulators.EBI
Sichuan University
Discovery of 4'-OH-flurbiprofen Mannich base derivatives as potential Alzheimer's disease treatment with multiple inhibitory activities.EBI
Sichuan University
Discovery of Zanubrutinib (BGB-3111), a Novel, Potent, and Selective Covalent Inhibitor of Bruton's Tyrosine Kinase.EBI
TBA
Design, synthesis and biological evaluation of quinoline-indole derivatives as anti-tubulin agents targeting the colchicine binding site.EBI
China Pharmaceutical University
Discovery of novel 9H-purin derivatives as dual inhibitors of HDAC1 and CDK2.EBI
Chongqing Medical University
The synthesis of 4-arylamido-2-arylaminoprimidines as potent EGFR T790M/L858R inhibitors for NSCLC.EBI
Shenyang Pharmaceutical University
Discovery, cocrystallization and biological evaluation of novel piperidine derivatives as high affinity Ls-AChBP ligands possessing α7 nAChR activities.EBI
Fudan University
Structure-Activity Relationship Study of Novel 6-Aryl-2-benzoyl-pyridines as Tubulin Polymerization Inhibitors with Potent Antiproliferative Properties.EBI
University of Tennessee Health Science Center
Germacrane Sesquiterpenoids as a New Type of Anticardiac Fibrosis Agent Targeting Transforming Growth Factor β Type I Receptor.EBI
Sun Yat-Sen University
Synthesis and Structure-Activity Relationship Correlations of Gnidimacrin Derivatives as Potent HIV-1 Inhibitors and HIV Latency Reversing Agents.EBI
Toho University
Design, synthesis and pharmacological evaluation of a novel mTOR-targeted anti-EV71 agent.EBI
National Engineering Research Center For The Emergency Drug
Design, synthesis and evaluation of novel 7H-pyrrolo[2,3-d]pyrimidin-4-amine derivatives as potent, selective and reversible Bruton's tyrosine kinase (BTK) inhibitors for the treatment of rheumatoid arthritis.EBI
Sichuan University and Collaborative Innovation Center
Discovery of Peptide Boronate Derivatives as Histone Deacetylase and Proteasome Dual Inhibitors for Overcoming Bortezomib Resistance of Multiple Myeloma.EBI
Shandong University
Design, synthesis and structure-activity relationship study of aminopyridine derivatives as novel inhibitors of Janus kinase 2.EBI
East China University of Science & Technology
Design, synthesis, and biological evaluation of truncated deguelin derivatives as Hsp90 inhibitors.EBI
China Pharmaceutical University
Discovery of Novel Quinoline-Chalcone Derivatives as Potent Antitumor Agents with Microtubule Polymerization Inhibitory Activity.EBI
China Pharmaceutical University
Discovery of a Highly Selective and Potent κ Opioid Receptor Agonist from EBI
Fudan University
Design, synthesis, and evaluation of compounds capable of reducing Pseudomonas aeruginosa virulence.EBI
Texas Tech University Health Sciences Center
Design, synthesis and biological evaluation of curcumin analogues as novel LSD1 inhibitors.EBI
Shenyang Pharmaceutical University
Discovery of novel, potent, isosteviol-based antithrombotic agents.EBI
Peking University
Transition State-Based Sialyltransferase Inhibitors: Mimicking Oxocarbenium Ion by Simple Amide.EBI
Peking University
Design, Synthesis, and Evaluation of Orally Available Clioquinol-Moracin M Hybrids as Multitarget-Directed Ligands for Cognitive Improvement in a Rat Model of Neurodegeneration in Alzheimer's Disease.EBI
Sun Yat-Sen University
Sterol fatty acid esters from the mushroom Hericium erinaceum and their PPAR transactivational effects.EBI
Yeungnam University
Discovery and early clinical evaluation of BMS-605339, a potent and orally efficacious tripeptidic acylsulfonamide NS3 protease inhibitor for the treatment of hepatitis C virus infection.EBI
Bristol-Myers Squibb Research and Development
Synthesis and pharmacological evaluation of aminothiazolomorphinans at the mu and kappa opioid receptors.EBI
Harvard Medical School
Discovery of inhibitors to block interactions of HIV-1 integrase with human LEDGF/p75 via structure-based virtual screening and bioassays.EBI
East China University of Science and Technology
Synthesis and biological evaluation of 1-benzylidene-3,4-dihydronaphthalen-2-one as a new class of microtubule-targeting agents.EBI
Second Military Medical University
Synthesis, biological evaluation and molecular docking studies of 1,3,4-thiadiazole derivatives containing 1,4-benzodioxan as potential antitumor agents.EBI
Nanjing University
Exploration of piperidine-4-yl-aminopyrimidines as HIV-1 reverse transcriptase inhibitors. N-Phenyl derivatives with broad potency against resistant mutant viruses.EBI
Roche R&D Center China
Discovery of gamma-secretase inhibitors efficacious in a transgenic animal model of Alzheimer's disease.EBI
Schering-Plough Research Institute
Tetrahydroquinoline sulfonamides as gamma-secretase inhibitors.EBI
Schering-Plough Research Institute
2,6-Disubstituted N-arylsulfonyl piperidines as gamma-secretase inhibitors.EBI
Schering-Plough Research Institute
Nocathiacin I analogues: synthesis, in vitro and in vivo biological activity of novel semi-synthetic thiazolyl peptide antibiotics.EBI
The Bristol-Myers Squibb Pharmaceutical Research Institute
Design, synthesis and in vitro anti-Zika virus evaluation of novel Sinefungin derivatives.EBI
Peking Union Medical College
Design, synthesis and biological evaluation of novel xanthine oxidase inhibitors bearing a 2-arylbenzo[b]furan scaffold.EBI
China Pharmaceutical University
The development of piperidinones as potent MDM2-P53 protein-protein interaction inhibitors for cancer therapy.EBI
International Institute For Translational Chinese Medicine
Discovery of 3-Cyano- N-(3-(1-isobutyrylpiperidin-4-yl)-1-methyl-4-(trifluoromethyl)-1 H-pyrrolo[2,3- b]pyridin-5-yl)benzamide: A Potent, Selective, and Orally Bioavailable Retinoic Acid Receptor-Related Orphan Receptor C2 Inverse Agonist.EBI
Karo Pharma
Triazole-linked transition state analogs as selective inhibitors against V. cholerae sialidase.EBI
University of California-Davis
Elimination of HIV-1 Latently Infected Cells by Gnidimacrin and a Selective HDAC Inhibitor.EBI
Duke University Medical Center
In vitro and in vivo pharmacokinetic and pharmacodynamic study of MBRI-001, a deuterium-substituted plinabulin derivative as a potent anti-cancer agent.EBI
Ocean University of China
7β-Methyl substituent is a structural locus associated with activity cliff for nepenthone analogues.EBI
Fudan University
Design, synthesis and anticancer evaluation of acridine hydroxamic acid derivatives as dual Topo and HDAC inhibitors.EBI
Tsinghua University
Design, synthesis, and biological evaluation of novel 3-substituted imidazo[1,2-a]pyridine and quinazolin-4(3H)-one derivatives as PI3Kα inhibitors.EBI
Shenyang Pharmaceutical University
Identification of caffeoylquinic acid derivatives as natural protein tyrosine phosphatase 1B inhibitors from Artemisia princeps.EBI
China Pharmaceutical University
Design, synthesis and evaluate of novel dual FGFR1 and HDAC inhibitors bearing an indazole scaffold.EBI
Nanjing University of Chinese Medicine
Phthalimide conjugations for the degradation of oncogenic PI3K.EBI
Tsinghua University
Synthesis and anti-tumor activity of EF24 analogues as IKKβ inhibitors.EBI
The First Affiliated Hospital of Wenzhou Medical University
Prenylated flavonoids as potent phosphodiesterase-4 inhibitors from Morus alba: Isolation, modification, and structure-activity relationship study.EBI
Sun Yat-Sen University
Discovery of 1-(3-aryl-4-chlorophenyl)-3-(p-aryl)urea derivatives against breast cancer by inhibiting PI3K/Akt/mTOR and Hedgehog signalings.EBI
Tsinghua University
Discovery of novel 20S proteasome inhibitors by rational topology-based scaffold hopping of bortezomib.EBI
Fudan University
Isosteroidal alkaloids as potent dual-binding site inhibitors of both acetylcholinesterase and butyrylcholinesterase from the bulbs of Fritillaria walujewii.EBI
Tianjin University of Technology
Design, synthesis and biological evaluation of novel 4-phenoxyquinoline derivatives containing 3-oxo-3,4-dihydroquinoxaline moiety as c-Met kinase inhibitors.EBI
Shenyang Pharmaceutical University
Discovery of dual Axl/VEGF-R2 inhibitors as potential anti-angiogenic and anti-metastatic drugs for cancer chemotherapy.EBI
Rigel Pharmaceuticals
3D-QSAR (CoMFA, CoMSIA), molecular docking and molecular dynamics simulations study of 6-aryl-5-cyano-pyrimidine derivatives to explore the structure requirements of LSD1 inhibitors.EBI
Zhengzhou University
Design, synthesis, and docking studies of quinazoline analogues bearing aryl semicarbazone scaffolds as potent EGFR inhibitors.EBI
Jiangxi Science & Technology Normal University
Developing DYRK inhibitors derived from the meridianins as a means of increasing levels of NFAT in the nucleus.EBI
Rigel Pharmaceuticals
Thyroid hormone receptor agonistsBDB
Inventisbio
METTL3 INHIBITOR COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOFBDB
Global Health Drug Discovery Institute
7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOFBDB
Biosplice Therapeutics
ULK1 AND ULK2 INHIBITORSBDB
Michigan State University
TAU-TUBULIN KINASE (TTBK) INHIBITOR COMPOUNDSBDB
Csic
HETEROCYCLIC DERIVATIVE INHIBITOR AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOFBDB
Shanghai Hansoh Biomedical
PIPERIDINYLPYRIDINYLCARBONITRILE DERIVATIVES AS INHIBITORS OF GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE AND GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE LIKE PROTEINBDB
Boehringer Ingelheim International
CD73 INHIBITOR AND USE THEREOFBDB
Wuhan Humanwell Innovative Drug Research and Development Center
Compounds for the modulation of cyclophilins functionBDB
The University Court of The University of Edinburgh
Pyrazolopyrimidine compounds as adenosine receptor antagonistsBDB
Exscientia
Steroids and protein-conjugates thereofBDB
Regeneron Pharmaceuticals
Benzenesulfonylbenazamide compound for inhibiting BCL-2 protein and composition and use thereofBDB
Shenzhen Targetrx
Azaindole derivatives and their use as ERK kinase inhibitorsBDB
Agv Discovery
Optically active crosslinked cyclic secondary amine derivativeBDB
Sumitomo Dainippon Pharma
Dual mode of action soluble guanylate cyclase activators and phosphodiesterase inhibitors and uses thereofBDB
Topadur Pharma
Crystal form of urate transporter 1 inhibitor and preparation method and use thereofBDB
Tianjin Institute of Pharmaceutical Research
JAK1 selective inhibitorsBDB
Astrazeneca
(Aza)pyridopyrazolopyrimidinones and indazolopyrimidinones and their useBDB
Bayer Pharma Aktiengesellschaft
Substituted bicyclic dihydropyrimidinones and their use as inhibitors of neutrophil elastase activityBDB
Boehringer Ingelheim International
Antibody-drug conjugates and immunotoxinsBDB
Oncomatryx Biopharma
Substituted pyrido[4,3-d]pyrimidines as Wee-1 inhibitorsBDB
Almac Discovery
Urease inhibitors from Hypericum oblongifolium WALL.BDB
University of Peshawar
Tryptophan-Rich Sensory Protein/Translocator Protein (TSPO) from Cyanobacterium Fremyella diplosiphon Binds a Broad Range of Functionally Relevant Tetrapyrroles.BDB
Michigan State University
Chemical compoundsBDB
Astrazeneca
2-aminoquinoline-based compounds for potent and selective neuronal nitric oxide synthase inhibitionBDB
Northwestern University
In silico binding analysis and SAR elucidations of newly designed benzopyrazine analogs as potent inhibitors of thymidine phosphorylase.BDB
Universiti Teknologi Mara (Uitm)
Pyrrolopyrimidine compounds as inhibitors of CDK4/6BDB
Novartis
2,3-disubstituted pyrazinesulfonamides as CRTH2 inhibitorsBDB
Merck Serono
Pyrazolopyrimidine JAK inhibitor compounds and methodsBDB
Genentech
Protein kinase inhibitorsBDB
Tiger Pharmatech
Glucagon receptor modulatorsBDB
Pfizer
Inhibition of AcpA phosphatase activity with ascorbate attenuates Francisella tularensis intramacrophage survival.BDB
University of Florida
A novel, potent, and selective 5-HT(7) antagonist: (R)-3-(2-(2-(4-methylpiperidin-1-yl)ethyl)pyrrolidine-1-sulfonyl) phen ol (SB-269970).BDB
Smithkline Beecham Pharmaceuticals
Putative selective 5-HT-2 antagonists block serotonin 5-HT-1c receptors in the choroid plexus.BDB
Vanderbilt University
Novel potent hepatitis C virus NS3 serine protease inhibitors derived from proline-based macrocycles.BDB
Schering-Plough Research Institute
The reversed binding of beta-phenethylamine inhibitors of DPP-IV: X-ray structures and properties of novel fragment and elaborated inhibitors.BDB
Santhera Pharmaceuticals
Structure-based drug design and structural biology study of novel nonpeptide inhibitors of severe acute respiratory syndrome coronavirus main protease.BDB
National Defense Medical Center
 
Thermodynamics of Binding of 2-Methoxy-3-isopropylpyrazine and 2-Methoxy-3-isobutylpyrazine to the Major Urinary ProteinBDB
University of Leeds