PMID
Cmpds
Data
Article Title
Organization
12
Design, synthesis and biological evaluation of 4-aminopyrimidine-5-cabaldehyde oximes as dual inhibitors of c-Met and VEGFR-2.

China Pharmaceutical University
1
Structural Analysis of the Binding of Type I, I1/2, and II Inhibitors to Eph Tyrosine Kinases.

University of Zurich
10
Optimization of inhibitors of the tyrosine kinase EphB4. 2. Cellular potency improvement and binding mode validation by X-ray crystallography.

University of Zurich
11
Novel oxysterols activate the Hedgehog pathway and induce osteogenesis.

Fate Therapeutics
14
A novel series of l-2-benzyloxycarbonylamino-8-(2-pyridyl)-disulfidyloctanoic acid derivatives as histone deacetylase inhibitors: design, synthesis and molecular modeling study.

Dalian University of Technology
2
Cytosporone B is an agonist for nuclear orphan receptor Nur77.

Xiamen University
69
Identification of novel series of human CCR1 antagonists.

Tanabe Research Laboratories Usa
352
Discovery of kinase inhibitors by high-throughput docking and scoring based on a transferable linear interaction energy model.

University of Zurich
136
Novel bisaryl substituted thiazoles and oxazoles as highly potent and selective peroxisome proliferator-activated receptor delta agonists.

The Genomics Institute of The Novartis Research Foundation
21
Structure-based optimization of potent and selective inhibitors of the tyrosine kinase erythropoietin producing human hepatocellular carcinoma receptor B4 (EphB4).

University of Zurich
21
Identification of Structurally Novel KRASG12C Inhibitors through Covalent DNA-Encoded Library Screening.

Amgen
39
Discovery of Novel TYRO3/MERTK Dual Inhibitors.

University of North Carolina at Chapel Hill
3
Discovery of CLKs inhibitors for the treatment of non-small cell lung cancer.

China Pharmaceutical University
5
Structure-based discovery of a 4,5-Dihydropyrazole-cored PET ligand for imaging of receptor-interacting serine/threonine-protein kinase 1 (RIPK1) in the brain.

Beijing Normal University
4
Preclinical Evaluation of Dihydropyrazole-Cored Positron Emission Tomography (PET) Ligands for Imaging of Receptor-Interacting Serine/Threonine Protein Kinase 1 (RIPK1) in the Brain.

Beijing Normal University
12
Identification of Dihydrobenzofuran Neolignans as Novel PDE4 Inhibitors and Evaluation of Antiatopic Dermatitis Efficacy in DNCB-Induced Mice Model.

Shanghai University of Traditional Chinese Medicine
25
Design, synthesis, and biological evaluation of 5-(1H-indol-5-yl)isoxazole-3-carboxylic acids as novel xanthine oxidase inhibitors.

Wuhan Institute of Technology
1
Discovery of the First Raptor (Regulatory-Associated Protein of mTOR) Inhibitor as a New Type of Antiadipogenic Agent.

Sun Yat-Sen University
48
Design and Synthesis of Novel Cereblon Binders for Use in Targeted Protein Degradation.

Bristol Myers Squibb
32
Structure-activity relationships of novel, highly potent, selective, and orally active CCR1 antagonists.

Tanabe Research Laboratories
19
Discovery of Novel PTP1B Inhibitors with Once-Weekly Therapeutic Potential for Type 2 Diabetes: Design, Synthesis, and

Qingdao University
2
Discovery of Spiro[pyrrolidine-3,3'-oxindole] LXRβ Agonists for the Treatment of Osteoporosis.

Sun Yat-Sen University
25
Diaryl substituted pyrazoles as potent CCR2 receptor antagonists.

Merck Research Laboratories
38
Development of Novel IP6K Inhibitors for the Treatment of Obesity and Obesity-Induced Metabolic Dysfunctions.

University of North Carolina at Chapel Hill
21
3-[Substituted]-5-(5-pyridin-2-yl-2H-tetrazol-2-yl)benzonitriles: identification of highly potent and selective metabotropic glutamate subtype 5 receptor antagonists.

Merck Research Laboratories
4
Discovery of cell-permeable non-peptide inhibitors of beta-secretase by high-throughput docking and continuum electrostatics calculations.

University of ZüRich
37
Efficient evaluation of binding free energy using continuum electrostatics solvation.

University of ZüRich
23
1,4,9-Triazaspiro[5.5]undecan-2-one Derivatives as Potent and Selective METTL3 Inhibitors.

University of Zurich
13
Discovery of highly potent, selective, orally bioavailable, metabotropic glutamate subtype 5 (mGlu5) receptor antagonists devoid of cytochrome P450 1A2 inhibitory activity.

Merck Research Laboratories
13
2-(2-[3-(pyridin-3-yloxy)phenyl]-2H-tetrazol-5-yl) pyridine: a highly potent, orally active, metabotropic glutamate subtype 5 (mGlu5) receptor antagonist.

Merck Research Laboratories
18
Discovery of novel heteroarylazoles that are metabotropic glutamate subtype 5 receptor antagonists with anxiolytic activity.

TBA
18
5-[(2-Methyl-1,3-thiazol-4-yl)ethynyl]-2,3'-bipyridine: a highly potent, orally active metabotropic glutamate subtype 5 (mGlu5) receptor antagonist with anxiolytic activity.

Merck Research Laboratories
27
Structure-guided design and development of novel N-phenylpyrimidin-2-amine derivatives as potential c-Met inhibitors.

Hebei University of Science and Technology
52
Discovery of the Selective Protein Kinase C-θ Kinase Inhibitor, CC-90005.

Bristol Myers Squibb
1
Synthesis, biological evaluation and structure-activity relationship of novel dichloroacetophenones targeting pyruvate dehydrogenase kinases with potent anticancer activity.

Chongqing University
6
Discovery of Novel PTP1B Inhibitors Derived from the BH3 Domain of Proapoptotic Bcl-2 Proteins with Antidiabetic Potency.

Qingdao University of Science and Technology
1
CC-90009: A Cereblon E3 Ligase Modulating Drug That Promotes Selective Degradation of GSPT1 for the Treatment of Acute Myeloid Leukemia.

Bristol Myers Squibb
20
Ligand-based optimization to identify novel 2-aminobenzo[d]thiazole derivatives as potent sEH inhibitors with anti-inflammatory effects.

Shenyang Pharmaceutical University
25
Development of dual inhibitors targeting pyruvate dehydrogenase kinases and human lactate dehydrogenase A: High-throughput virtual screening, synthesis and biological validation.

Chongqing University
53
Engineering of a Potent, Long-Acting NPY2R Agonist for Combination with a GLP-1R Agonist as a Multi-Hormonal Treatment for Obesity.

The Scripps Research Institute
2
Discovery of CRBN E3 Ligase Modulator CC-92480 for the Treatment of Relapsed and Refractory Multiple Myeloma.

Celgene
18
Hitting a Moving Target: Simulation and Crystallography Study of ATAD2 Bromodomain Blockers.

University of Zurich
2
Structure-Based Discovery of a Subtype-Selective Inhibitor Targeting a Transient Receptor Potential Vanilloid Channel.

Chinese Academy of Sciences
35
High-Affinity Alkynyl Bisubstrate Inhibitors of Nicotinamide

Biokin
35
Synthesis and Biological Evaluation of B-Cell Lymphoma 6 Inhibitors of

East China Normal University and Shanghai Fengxian District Central Hospital Joint Center For Translational Medicine
4
Phenolic group on A-ring is key for dracoflavan B as a selective noncompetitive inhibitor of α-amylase.

National University of Singapore
19
Design, synthesis, and biological activity of novel dicoumarol glucagon-like peptide 1 conjugates.

China Pharmaceutical University
5
Is quantum mechanics necessary for predicting binding free energy?

University of Z£Rich
41
Exploration of novel pyrrolo[2,1-f][1,2,4]triazine derivatives with improved anticancer efficacy as dual inhibitors of c-Met/VEGFR-2.

China Pharmaceutical University
28
Discovery of an Orally Bioavailable Dual PI3K/mTOR Inhibitor Based on Sulfonyl-Substituted Morpholinopyrimidines.

Shanghai Haiyan Pharmaceutical Technology
23
Synthesis and biological evaluation of novel 6,11-dihydro-5H-benzo[e]pyrimido- [5,4-b][1,4]diazepine derivatives as potential c-Met inhibitors.

Shanghai Institute of Pharmaceutical Industry
36
Identification of Potent and Selective RIPK2 Inhibitors for the Treatment of Inflammatory Diseases.

Genomics Institute of The Novartis Research Foundation
1
The Discovery of a Dual TTK Protein Kinase/CDC2-Like Kinase (CLK2) Inhibitor for the Treatment of Triple Negative Breast Cancer Initiated from a Phenotypic Screen.

Celgene
2
COMBINATIONS OF CTPS1 AND BCL2 INHIBITORS FOR CANCER

Step Pharma
315
Substituted bicyclic compounds useful as T cell activators

Bristol Myers Squibb
4
3-CYCLIC AMINE-INDOLE DERIVATIVES AS SEROTONERGIC AGENTS FOR THE TREATMENT OF CNS DISORDERS

Mindset Pharma
34
Fused pyrimidine derivatives as A2A / A2B inhibitors

Incyte
2
Compounds as neurokinin-1 receptor antagonists and uses thereof

XWPharma
106
Morphinan derivatives for the treatment of neuropathic pain

Nektar Therapeutics
14
Differential actions of antiparkinson agents at multiple classes of monoaminergic receptor. I. A multivariate analysis of the binding profiles of 14 drugs at 21 native and cloned human receptor subtypes.

Institut De Recherches Servier
3
Biochemical and pharmacological characterization of L-659,989: an extremely potent, selective and competitive receptor antagonist of platelet-activating factor.

Merck Sharp & Dohme Research Laboratories
5
Ultrahigh resolution crystal structures of human carbonic anhydrases I and II complexed with "two-prong" inhibitors reveal the molecular basis of high affinity.

University of Pennsylvania
11
SAR and inhibitor complex structure determination of a novel class of potent and specific Aurora kinase inhibitors.

AstraZeneca