PMID
Cmpds
Data
Article Title
Organization
60
Discovery of Potent, Selective Stem Cell Factor Receptor/Platelet Derived Growth Factor Receptor Alpha (c-KIT/PDGFRa) Dual Inhibitor for the Treatment of Imatinib-Resistant Gastrointestinal Stromal Tumors (GISTs).

East China University of Science and Technology
44
Development of the First Generation of Disulfide-Based Subtype-Selective and Potent Covalent Pyruvate Dehydrogenase Kinase 1 (PDK1) Inhibitors.

East China University of Science and Technology
33
Structure-based optimization leads to the discovery of NSC765844, a highly potent, less toxic and orally efficacious dual PI3K/mTOR inhibitor.

Second Military Medical University
13
Discovery of Cell-Permeable O-GlcNAc Transferase Inhibitors via Tethering in Situ Click Chemistry.

University of Chinese Academy of Sciences
31
Synthesis and biological evaluation of ranitidine analogs as multiple-target-directed cognitive enhancers for the treatment of Alzheimer's disease.

University of South Carolina
2
Discovery of a Potent Acyclic, Tripeptidic, Acyl Sulfonamide Inhibitor of Hepatitis C Virus NS3 Protease as a Back-up to Asunaprevir with the Potential for Once-Daily Dosing.

Bristol Myers Squibb
21
Design, synthesis, and activity evaluation of selective inhibitors of anti-apoptotic Bcl-2 proteins: The effects on the selectivity of the P1 pockets in the active sites.

China Pharmaceutical University
42
Development of Multifunctional Pyrimidinylthiourea Derivatives as Potential Anti-Alzheimer Agents.

East China University of Science and Technology
3
Structural modification of luteolin from Flos Chrysanthemi leads to increased tumor cell growth inhibitory activity.

Second Military Medical University
19
Discovery and Preclinical Evaluation of BMS-711939, an Oxybenzylglycine Based PPARa Selective Agonist.

Bristol Myers Squibb
38
Discovery of Benzocycloalkane Derivatives Efficiently Blocking Bacterial Virulence for the Treatment of Methicillin-Resistant S. aureus (MRSA) Infections by Targeting Diapophytoene Desaturase (CrtN).

East China University of Science and Technology
16
Twenty Crystal Structures of Bromodomain and PHD Finger Containing Protein 1 (BRPF1)/Ligand Complexes Reveal Conserved Binding Motifs and Rare Interactions.

University of Z£Rich
6
Discovery of Potent Benzofuran-Derived Diapophytoene Desaturase (CrtN) Inhibitors with Enhanced Oral Bioavailability for the Treatment of Methicillin-Resistant Staphylococcus aureus (MRSA) Infections.

East China University of Science and Technology
13
The"Gatekeeper" Residue Influences the Mode of Binding of Acetyl Indoles to Bromodomains.

University of Z£Rich
13
A new GLP-1 analogue with prolonged glucose-lowering activity in vivo via backbone-based modification at the N-terminus.

Peking University
13
Discovery of benzenesulfonamide derivatives as potent PI3K/mTOR dual inhibitors with in vivo efficacies against hepatocellular carcinoma.

Second Military Medical University
19
Design, Synthesis, and Pharmacological Evaluation of Fusedß-Homophenylalanine Derivatives as Potent DPP-4 Inhibitors.

Chinese Academy of Sciences
11
Virtual High-Throughput Screening To Identify Novel Activin Antagonists.

Northwestern University
4
Synthesis and biological evaluation of novel pyrazoline derivatives as potent anti-inflammatory agents.

Sichuan University
7
Quantum chemistry calculation-aided structural optimization of combretastatin A-4-like tubulin polymerization inhibitors: improved stability and biological activity.

Second Military Medical University
54
Design, synthesis, X-ray crystallographic analysis, and biological evaluation of thiazole derivatives as potent and selective inhibitors of human dihydroorotate dehydrogenase.

East China University of Science and Techology
33
Optimization beyond AMG 232: discovery and SAR of sulfonamides on a piperidinone scaffold as potent inhibitors of the MDM2-p53 protein-protein interaction.

Amgen
14
Novel styryl-indoles as small molecule inhibitors of 25-hydroxyvitamin D-24-hydroxylase (CYP24A1): Synthesis and biological evaluation.

Cardiff University
22
Small-molecule inhibitors of 25-hydroxyvitamin D-24-hydroxylase (CYP24A1): synthesis and biological evaluation.

Cardiff University
39
4-Benzofuranyloxynicotinamide derivatives are novel potent and orally available TGR5 agonists.

Chinese Academy of Sciences
31
Design and synthesis of phenylisoxazole derivatives as novel human acrosin inhibitors.

Second Military Medical University
29
Discovery of (10R)-7-amino-12-fluoro-2,10,16-trimethyl-15-oxo-10,15,16,17-tetrahydro-2H-8,4-(metheno)pyrazolo[4,3-h][2,5,11]-benzoxadiazacyclotetradecine-3-carbonitrile (PF-06463922), a macrocyclic inhibitor of anaplastic lymphoma kinase (ALK) and c-ros oncogene 1 (ROS1) with preclinical brain expo

Pfizer
15
Identification of 1-{2-[4-chloro-1'-(2,2-dimethylpropyl)-7-hydroxy-1,2-dihydrospiro[indole-3,4'-piperidine]-1-yl]phenyl}-3-{5-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl}urea, a potent, efficacious and orally bioavailable P2Y(1) antagonist as an antiplatelet agent.

Bristol Myers Squibb
5
Subtype-selective nicotinic receptor antagonists: potential as tobacco use cessation agents.

University of Kentucky
46
Discovery of AMG 232, a potent, selective, and orally bioavailable MDM2-p53 inhibitor in clinical development.

Amgen
2
Design of potent and selective inhibitors to overcome clinical anaplastic lymphoma kinase mutations resistant to crizotinib.

Pfizer
6
Structure-activity relationship (SAR) optimization of 6-(indol-2-yl)pyridine-3-sulfonamides: identification of potent, selective, and orally bioavailable small molecules targeting hepatitis C (HCV) NS4B.

Ptc Therapeutics
48
Discovery and optimization of 5-(2-((1-(phenylsulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl)oxy)pyridin-4-yl)-1,2,4-oxadiazoles as novel gpr119 agonists.

Amgen
21
Discovery and optimization of N-(3-(1,3-dioxo-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-yloxy)phenyl)benzenesulfonamides as novel GPR119 agonists.

Amgen
21
Discovery of 2-methylpyridine-based biaryl amides as¿-secretase modulators for the treatment of Alzheimer's disease.

Amgen
32
Design, synthesis and biological evaluation of a novel class of potent TGR5 agonists based on a 4-phenyl pyridine scaffold.

Chinese Academy of Sciences
48
Novel selective and potent inhibitors of malaria parasite dihydroorotate dehydrogenase: discovery and optimization of dihydrothiophenone derivatives.

State Key Laboratory of Bioreactor Engineering
34
Synthesis and acrosin inhibitory activities of 5-phenyl-1H-pyrazole-3-carboxylic acid amide derivatives.

Second Military Medical University
31
Discovery and optimization of arylsulfonyl 3-(pyridin-2-yloxy)anilines as novel GPR119 agonists.

Amgen
13
Discovery of the Highly Potent PI3K/mTOR Dual Inhibitor PF-04979064 through Structure-Based Drug Design.

Pfizer
6
Development of substituted N-[3-(3-methoxylphenyl)propyl] amides as MT(2)-selective melatonin agonists: improving metabolic stability.

Hong Kong University of Science and Technology
21
Design and synthesis of novel benzoheterocyclic derivatives as human acrosin inhibitors by scaffold hopping.

Second Military Medical University
19
Discovery of diverse human dihydroorotate dehydrogenase inhibitors as immunosuppressive agents by structure-based virtual screening.

State Key Laboratory of Bioreactor Engineering
23
Discovery and Development of Potent LFA-1/ICAM-1 Antagonist SAR 1118 as an Ophthalmic Solution for Treating Dry Eye.

TBA
26
Synthesis and acrosin inhibitory activity of methyl 5-substituted-1H-benzo[d]imidazol-2-yl carbamate derivatives.

Second Military Medical University
10
Highly Selective and Potent Thiophenes as PI3K Inhibitors with Oral Antitumor Activity.

TBA
9
Diazinones as P2 replacements for pyrazole-based cathepsin S inhibitors.

Johnson & Johnson Pharmaceutical Research & Development
10
Structure-based design and synthesis of (5-arylamino-2H-pyrazol-3-yl)-biphenyl-2',4'-diols as novel and potent human CHK1 inhibitors.

Pfizer
38
bis-Azaaromatic quaternary ammonium analogues: ligands for alpha4beta2* and alpha7* subtypes of neuronal nicotinic receptors.

University of Kentucky
11
Studies on gambogic acid (IV): Exploring structure-activity relationship with I¿B kinase-beta (IKKß).

China Pharmaceutical University
56
Discovery of dehydro-oxopiperazine acetamides as novel bradykinin B1 receptor antagonists with enhanced in vitro potency.

Amgen
14
Design, synthesis, and activity evaluation of broad-spectrum small-molecule inhibitors of anti-apoptotic Bcl-2 family proteins: characteristics of broad-spectrum protein binding and its effects on anti-tumor activity.

Second Military Medical University
37
Synthesis and acrosin inhibitory activity of substituted 4-amino-N-(diaminomethylene) benzenesulfonamide derivatives.

Second Military Medical University
23
Synthesis and acrosin inhibitory activities of substituted ethyl 5-(4-aminophenyl)-1H-pyrazole-3-carboxylate derivatives.

Second Military Medical University
58
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.

China Pharmaceutical University
11
Design and synthesis of small molecule RhoA inhibitors: a new promising therapy for cardiovascular diseases?

East China University of Science and Technology
38
3-Oxo-2-piperazinyl acetamides as potent bradykinin B1 receptor antagonists for the treatment of pain and inflammation.

Amgen
28
Structure-activity relationship (SAR) of thea-amino acid residue of potent tetrahydroisoquinoline (THIQ)-derived LFA-1/ICAM-1 antagonists.

Sunesis Pharmaceuticals
22
Discovery of tetrahydroisoquinoline (THIQ) derivatives as potent and orally bioavailable LFA-1/ICAM-1 antagonists.

Sunesis Pharmaceuticals
8
Inhibition of S-ribosylhomocysteinase (LuxS) by substrate analogues modified at the ribosyl C-3 position.

Florida International University
25
Pyrazole-based arylalkyne cathepsin S inhibitors. Part II: optimization of cellular potency.

Johnson & Johnson Pharmaceutical Research and Development
24
Discovering potent small molecule inhibitors of cyclophilin A using de novo drug design approach.

East China University of Science and Technology
20
Discovery of Potent PDEδ/NAMPT Dual Inhibitors: Preclinical Evaluation in KRAS Mutant Pancreatic Cancer Cells.

Shanghai University
32
Development of a Buchwald-Hartwig Amination for an Accelerated Library Synthesis of Cereblon Binders.

Bristol Myers Squibb
13
Allosteric inhibition of PTP1B by bromocatechol-chalcone derivatives.

Shandong University
27
Discovery of novel cyclopentane carboxylic acids as potent and selective inhibitors of NaV1.7.

Xenon Pharmaceuticals Inc.
17
Metabolism-guided development of Ko143 analogs as ABCG2 inhibitors.

University of Pittsburgh
3
Synthesis and bioevaluation of novel stilbene-based derivatives as tubulin/HDAC dual-target inhibitors with potent antitumor activities in vitro and in vivo.

China Pharmaceutical University
7
Design, synthesis, and biological evaluation of novel 1-amido-2-one-4-thio-deoxypyranose as potential antitumor agents for multiple myeloma.

Chinese Academy of Sciences
1
Antibody-drug conjugates for targeted cancer therapy: Recent advances in potential payloads.

Shaoxing University
36
Design, synthesis and structure-activity relationship of 1,8-naphthalimide derivatives as highly potent hCYP1B1 inhibitors.

Nanjing University of Chinese Medicine
1
Discovery and Optimization of WDR5 Inhibitors via Cascade Deoxyribonucleic Acid-Encoded Library Selection Approach.

Nanjing University of Chinese Medicine
1
Design, Synthesis, and Biological Evaluation for First GPX4 and CDK Dual Inhibitors.

China Pharmaceutical University
17
Discovery and Proof of Concept of Potent Dual Polθ/PARP Inhibitors for Efficient Treatment of Homologous Recombination-Deficient Tumors.

China Pharmaceutical University
10
Design of Selective PARP-1 Inhibitors and Antitumor Studies.

Shandong University
23
Triazoles in Medicinal Chemistry: Physicochemical Properties, Bioisosterism, and Application.

China Pharmaceutical University
21
Click chemistry-aided drug discovery: A retrospective and prospective outlook.

Hangzhou Normal University
1
Drug repurposing of propafenone to discover novel anti-tumor agents by impairing homologous recombination to delay DNA damage recovery of rare disease conjunctival melanoma.

East China University of Science and Technology
21
Design and Synthesis of Functionally Active 5-Amino-6-Aryl Pyrrolopyrimidine Inhibitors of Hematopoietic Progenitor Kinase 1.

Pfizer
1
Advances of bioorthogonal coupling reactions in drug development.

China Pharmaceutical University
40
PDE-10A inhibitors as insulin secretagogues.

Bayer Pharmaceuticals
66
R-isomers of Arg-Gly-Asp (RGD) mimics as potent alphavbeta3 inhibitors.

Pfizer
45
Discovery of a Bromodomain and Extra Terminal Domain (BET) Inhibitor with the Selectivity for the Second Bromodomain (BD2) and the Capacity for the Treatment of Inflammatory Diseases.

China Pharmaceutical University
47
3D-QSAR and molecular docking studies on benzothiazole derivatives as Candida albicans N-myristoyltransferase inhibitors.

Second Military Medical University
12
Evolution and Discovery of Matrine Derivatives as a New Class of Anti-Hepatic Fibrosis Agents Targeting Ewing Sarcoma Breakpoint Region 1 (EWSR1).

Peking Union Medical College
22
Discovery of novel PDE4 inhibitors targeting the M-pocket from natural mangostanin with improved safety for the treatment of Inflammatory Bowel Diseases.

Guangzhou University of Chinese Medicine
21
Discovery of novel 2-hydroxyl-4-benzyloxybenzyl aniline derivatives as potential multifunctional agents for the treatment of Parkinson's disease.

North Sichuan Medical College
8
Discovery, SAR Study of GST Inhibitors from a Novel Quinazolin-4(1

Chinese Academy of Sciences
2
Small-Molecule Hydrophobic Tagging: A Promising Strategy of Druglike Technology for Targeted Protein Degradation.

China Pharmaceutical University
3
Developing a Naïve Bayesian Classification Model with PI3Kγ structural features for virtual screening against PI3Kγ: Combining molecular docking and pharmacophore based on multiple PI3Kγ conformations.

Jiangnan University
12
Therapeutic potential of targeting SHP2 in human developmental disorders and cancers.

Zhejiang University
39
Discovery of novel dual RAGE/SERT inhibitors for the potential treatment of the comorbidity of Alzheimer's disease and depression.

East China University of Science and Technology
47
Non-peptidyl non-covalent cathepsin C inhibitoEEr bearing a unique thiophene-substituted pyridine: Design, structure-activity relationship and anti-inflammatory activity in vivo.

Anhui Medical University
9
Design and synthesis of substrate and intermediate analogue inhibitors of S-ribosylhomocysteinase.

The Ohio State University
1
Discovery of STAT3 and Histone Deacetylase (HDAC) Dual-Pathway Inhibitors for the Treatment of Solid Cancer.

China Pharmaceutical University
28
A new class of bradykinin 1 receptor antagonists containing the piperidine acetic acid tetralin core.

Amgen
85
Substituted indanylacetic acids as PPAR-alpha-gamma activators.

Bayer Research Center
47
Discovery of 1-(5-(1H-benzo[d]imidazole-2-yl)-2,4-dimethyl-1H-pyrrol-3-yl)ethan-1-one derivatives as novel and potent bromodomain and extra-terminal (BET) inhibitors with anticancer efficacy.

China Pharmaceutical University
27
Discovery of small-molecule compounds and natural products against Parkinson's disease: Pathological mechanism and structural modification.

Zhejiang University
33
Synthesis and evaluation of novel HER-2 inhibitors to exert anti-breast cancer ability through epithelial-mesenchymal transition (EMT) pathway.

China Medical University
30
Discovery of Reversible Covalent Bruton's Tyrosine Kinase Inhibitors PRN473 and PRN1008 (Rilzabrutinib).

Principia Biopharma, A Sanofi
64
Discovery of potent, orally available vanilloid receptor-1 antagonists. Structure-activity relationship of N-aryl cinnamides.

Amgen
5
Development of Alectinib-Based PROTACs as Novel Potent Degraders of Anaplastic Lymphoma Kinase (ALK).

China Pharmaceutical University
4
Drug Repurposing of Quisinostat to Discover Novel

East China University of Science and Technology
63
The novel therapeutic strategy of vilazodone-donepezil chimeras as potent triple-target ligands for the potential treatment of Alzheimer's disease with comorbid depression.

East China University of Science and Technology
20
Self-Masked Aldehyde Inhibitors: A Novel Strategy for Inhibiting Cysteine Proteases.

Texas A&M University
17
N-Aryl-gamma-lactams as integrin alphavbeta3 antagonists.

Amgen
22
Mangostanin Derivatives as Novel and Orally Active Phosphodiesterase 4 Inhibitors for the Treatment of Idiopathic Pulmonary Fibrosis with Improved Safety.

Hainan University
4
Peptidyl hydroxamic acids as methionine aminopeptidase inhibitors.

The Ohio State University
7
Enantiomeric profiling of a chiral benzothiazole necroptosis inhibitor.

Ningxia Medical University
5
Development of novel benzimidazole-derived neddylation inhibitors for suppressing tumor growth invitro and invivo.

East China University of Science and Technology
2
Discovery of Novel

East China University of Science and Technology
2
The discovery of novel small molecule allosteric activators of aldehyde dehydrogenase 2.

Second Military Medical University
3
(+)-Dinapsoline: an efficient synthesis and pharmacological profile of a novel dopamine agonist.

Bristol Myers Squibb
60
Development of disulfide-derived fructose-1,6-bisphosphatase (FBPase) covalent inhibitors for the treatment of type 2 diabetes.

East China University of Science and Technology
11
Synthesis and initial pharmacology of dual-targeting ligands for putative complexes of integrin αVβ3 and PAR2.

Marquette University
2
Discovery of bazedoxifene analogues targeting glycoprotein 130.

China Pharmaceutical University
25
Novel quinolin-4(1H)-one derivatives as multi-effective aldose reductase inhibitors for treatment of diabetic complications: Synthesis, biological evaluation, and molecular modeling studies.

Institute of Technology
26
Discovery of new small molecule inhibitors targeting isocitrate dehydrogenase 1 (IDH1) with blood-brain barrier penetration.

Chinese Academy of Sciences
2
Synthesis of N-hydroxycinnamoyl amide derivatives and evaluation of their anti-oxidative and anti-tyrosinase activities.

Beijing Technology and Business University
12
1-Phenyl-dihydrobenzoindazoles as novel colchicine site inhibitors: Structural basis and antitumor efficacy.

Second Military Medical University
16
Design, synthesis, evaluation and molecular modeling study of 4-N-phenylaminoquinolines for Alzheimer disease treatment.

Tianjin University of Technology
11
Discovery of naphthacemycins as a novel class of PARP1 inhibitors.

North China Pharmaceutical Group
57
Discovery of Benzo[

China Pharmaceutical University
7
Synthesis and biological evaluation of 7-methoxy-1-(3,4,5-trimethoxyphenyl)-4,5-dihydro-2H-benzo[e]indazoles as new colchicine site inhibitors.

Second Military Medical University
2
Review of the molecular mechanisms of Ganoderma lucidum triterpenoids: Ganoderic acids A, C2, D, F, DM, X and Y.

Shaanxi University of Science & Technology
14
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.

Sichuan University and Collaborative Innovation Center
10
Design, synthesis, and bioactivity evaluation of novel Bcl-2/HDAC dual-target inhibitors for the treatment of multiple myeloma.

Wuhan Polytechnic University
14
Structure-Property Basis for Solving Transporter-Mediated Efflux and Pan-Genotypic Inhibition in HCV NS5B Inhibitors.

Bristol Myers Squibb
15
Proteolysis Targeting Chimeras for the Selective Degradation of Mcl-1/Bcl-2 Derived from Nonselective Target Binding Ligands.

TBA
22
Identification, synthesis and pharmacological evaluation of novel anti-EV71 agents via cyclophilin A inhibition.

East China University of Science and Technology
25
Novel Series of Dihydropyridinone P2X7 Receptor Antagonists.

Hoffmann-La Roche
1
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.

Bristol Myers Squibb
2
Hepatitis C virus NS5A replication complex inhibitors: the discovery of daclatasvir.

Bristol Myers Squibb
13
Discovery of a potent dual EGFR/HER-2 inhibitor L-2 (selatinib) for the treatment of cancer.

Qilu Pharmaceutical
16
Synthesis, biological evaluation and molecular modeling of substituted 2-aminobenzimidazoles as novel inhibitors of acetylcholinesterase and butyrylcholinesterase.

Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Wuhan University)
8
Synthesis and biological evaluation of 1-benzylidene-3,4-dihydronaphthalen-2-one as a new class of microtubule-targeting agents.

Second Military Medical University
25
Combining pharmacophore, docking and substructure search approaches to identify and optimize novel B-RafV600E inhibitors.

Chinese Academy of Sciences
9
Synthesis, structure and antibacterial activity of new 2-(1-(2-(substituted-phenyl)-5-methyloxazol-4-yl)-3-(2-substitued-phenyl)-4,5-dihydro-1H-pyrazol-5-yl)-7-substitued-1,2,3,4-tetrahydroisoquinoline derivatives.

Anhui University of Technology
59
Structure-based discovery of selective BRPF1 bromodomain inhibitors.

University of Zurich
39
Novel Staphyloxanthin Inhibitors with Improved Potency against Multidrug Resistant

East China University of Science and Technology
16
Discovery of novel Syk/PDGFR-α/c-Kit inhibitors as multi-targeting drugs to treat rheumatoid arthritis.

East China University of Science & Technology
12
Binding Motifs in the CBP Bromodomain: An Analysis of 20 Crystal Structures of Complexes with Small Molecules.

University of Zurich
17
Discovery of novel purine nucleoside derivatives as phosphodiesterase 2 (PDE2) inhibitors: Structure-based virtual screening, optimization and biological evaluation.

East China University of Science and Technology
29
Discovery of new antimalarial agents: Second-generation dual inhibitors against FP-2 and PfDHFR via fragments assembely.

East China University of Science and Technology
13
Benzo[c][1,2,5]thiadiazole derivatives: A new class of potent Src homology-2 domain containing protein tyrosine phosphatase-2 (SHP2) inhibitors.

Jiangnan University
2
Design, Synthesis, and SAR of C-3 Benzoic Acid, C-17 Triterpenoid Derivatives. Identification of the HIV-1 Maturation Inhibitor 4-((1 R,3a S,5a R,5b R,7a R,11a S,11b R,13a R,13b R)-3a-((2-(1,1-Dioxidothiomorpholino)ethyl)amino)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-2,3,3a,4,5,5a,5b,6,7,7a,8,1

TBA
2
Discovery of novel piperonyl derivatives as diapophytoene desaturase inhibitors for the treatment of methicillin-, vancomycin- and linezolid-resistant Staphylococcus aureus infections.

East China University of Science and Technology
19
Discovery of novel propargylamine-modified 4-aminoalkyl imidazole substituted pyrimidinylthiourea derivatives as multifunctional agents for the treatment of Alzheimer's disease.

East China University of Science and Technology
4
The recent progress of isoxazole in medicinal chemistry.

China Pharmaceutical University
24
Design, synthesis and evaluation of vilazodone-tacrine hybrids as multitarget-directed ligands against depression with cognitive impairment.

East China University of Science and Technology
12
Synthesis, molecular modelling and CYP24A1 inhibitory activity of novel of (E)-N-(2-(1H-imidazol-1-yl)-2-(phenylethyl)-3/4-styrylbenzamides.

Cardiff University
6
Analysis of the binding sites of vitamin D 1α-hydroxylase (CYP27B1) and vitamin D 24-hydroxylase (CYP24A1) for the design of selective CYP24A1 inhibitors: Homology modelling, molecular dynamics simulations and identification of key binding requirements.

Cardiff University
1
Improving Metabolic Stability with Deuterium: The Discovery of BMT-052, a Pan-genotypic HCV NS5B Polymerase Inhibitor.

Bristol Myers Squibb
3
Allosteric Inhibitors of SHP2 with Therapeutic Potential for Cancer Treatment.

Chinese Academy of Sciences
2
Virtual screen to NMR (VS2NMR): Discovery of fragment hits for the CBP bromodomain.

University of Z£Rich
109
Novel Terminal Bipheny-Based Diapophytoene Desaturases (CrtN) Inhibitors as Anti-MRSA/VISR/LRSA Agents with Reduced hERG Activity.

East China University of Science and Technology
33
Optimization of Orally Bioavailable Enhancer of Zeste Homolog 2 (EZH2) Inhibitors Using Ligand and Property-Based Design Strategies: Identification of Development Candidate (R)-5,8-Dichloro-7-(methoxy(oxetan-3-yl)methyl)-2-((4-methoxy-6-methyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-3,4-dihydroisoquin

Wuxi Apptec
28
Discovery of novel 1,2,3,4-tetrahydrobenzo[4, 5]thieno[2, 3-c]pyridine derivatives as potent and selective CYP17 inhibitors.

Fudan University
94
Novel Inhibitors of Staphyloxanthin Virulence Factor in Comparison with Linezolid and Vancomycin versus Methicillin-Resistant, Linezolid-Resistant, and Vancomycin-Intermediate Staphylococcus aureus Infections in Vivo.

East China University of Science and Technology
8
Pyrazolopyrimidines as Potent Stimulators for Transient Receptor Potential Canonical 3/6/7 Channels.

Key Laboratory of Combinatorial Biosynthesis and Drug Discovery (Moe) and Hubei Provinc
184
NOVEL HETEROCYCLIC COMPOUND

Shouyao Holdings (Beijing) Co.
14
MULTICYCLIC COMPOUNDS

Slap Pharmaceuticals
20
MST1 kinase inhibitor and use thereof

Tarapeutics Science Inc.
67
HETEROCYCLIC DERIVATIVES AS MALT1 INHIBITORS

C4X Discovery
64
FUSED PYRAZOLE UREA ANALOGS AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS

Merck Sharp & Dohme
39
COMPOUND AS ATR KINASE INHIBITOR

Suzhou Ark Biopharmaceutical Co.
2
SUBSTITUTED PIPERIDINYL-METHYLPURINE PYRIDINES AND RELATED COMPOUNDS AND THEIR USE IN TREATING DISEASES AND CONDITIONS

K36 Therapeutics
225
Substituted pyridopyrimidinonyl compounds useful as T cell activators

Bristol Myers Squibb
465
Imidazolyl pyrimidinylamine compounds as CDK2 inhibitors

Incyte
58
Antibacterial compounds

Forge Therapeutics
17
P-phenylenediamine derivative as potassium channel regulator and preparation method and medical application thereof

Shanghai Zhimeng Biopharma
116
Cyclopropylamines as LSD1 inhibitors

Incyte
71
5-alkyl pyrrolidine orexin receptor agonists

Merck Sharp & Dohme
3
Discovery of S-217622, a Non-Covalent Oral SARS-CoV-2 3CL Protease Inhibitor Clinical Candidate for Treating COVID-19

Shionogi
17
Pyridine derivative as ASK1 inhibitor and preparation method and use thereof

Fujian Cosunter Pharmaceutical Co.
114
Substituted dihydroisoquinolinone compounds

Pfizer
9
Inhibitors of BCR-ABL mutants and use thereof

University of Michigan
14
Phosphorus-substituted quinoxaline-type piperidine compounds and uses thereof

Purdue Pharma
65
Amino compounds for treatment of complement mediated disorders

Achillion Pharmaceuticals
2
Matrix metalloproteinase inhibitors and methods for the treatment of pain and other diseases

TBA
2
Exploiting sp(2) -Hybridisation in the Development of Potent 1,5-a-l-Arabinanase Inhibitors.

University of Western Australia
1
Discovery of a Highly Selective STK16 Kinase Inhibitor.

Chinese Academy of Sciences
32
Chemical compounds

AstraZeneca
25
Mandelamide heterocyclic compounds

Bristol Myers Squibb
253
Chemical compounds

Boehringer Ingelheim International
1
Inhibition of arginine aminopeptidase by bestatin and arphamenine analogues. Evidence for a new mode of binding to aminopeptidases.

University of Wisconsin
6
P53 activating compounds

University Court of The University of Dundee
14
Biexponential kinetics of (R)-alpha-[3H]methylhistamine binding to the rat brain H3 histamine receptor.

Schering-Plough Research Institute
715
Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors

Array Biopharma
5
The complex of a bivalent derivative of galanthamine with torpedo acetylcholinesterase displays drastic deformation of the active-site gorge: implications for structure-based drug design.

Weizmann Institute of Science