PMID
Cmpds
Data
Article Title
Organization
74
Human drug-induced liver injury severity is highly associated with dual inhibition of liver mitochondrial function and bile salt export pump.

Pfizer
5
Identification of Potential Off-target Toxicity Liabilities of Catechol-O-methyltransferase Inhibitors by Differential Competition Capture Compound Mass Spectrometry.

Caprotec Bioanalytics
54
Design, synthesis and evaluation of scutellarein-O-alkylamines as multifunctional agents for the treatment of Alzheimer's disease.

Sichuan University
30
Development of novel ACK1/TNK2 inhibitors using a fragment-based approach.

University of South Florida
19
An Orally Available BACE1 Inhibitor That Affords Robust CNS A Reduction without Cardiovascular Liabilities.

Amgen
6
New efficient imidazolium aldoxime reactivators for nerve agent-inhibited acetylcholinesterase.

Institute of Pharmacology and Toxicology
31
Design, synthesis and bioevaluation of N-trisubstituted pyrimidine derivatives as potent aurora A kinase inhibitors.

Sun Yat-Sen University
9
Crystal Structures of PI3Kα Complexed with PI103 and Its Derivatives: New Directions for Inhibitors Design.

Shanghai Jiao Tong University
21
Discovery of 2-methylpyridine-based biaryl amides as -secretase modulators for the treatment of Alzheimer's disease.

Amgen
24
The discovery and optimization of novel dual inhibitors of topoisomerase II and histone deacetylase.

East China Normal University
10
Indazoles as potential c-Met inhibitors: design, synthesis and molecular docking studies.

Guangdong Pharmaceutical University
19
Synthesis, biological evaluation, and molecular docking studies of novel 1,3,4-oxadiazole derivatives possessing benzotriazole moiety as FAK inhibitors with anticancer activity.

Nanjing University
5
The discovery of colchicine-SAHA hybrids as a new class of antitumor agents.

East China Normal University
22
Synthesis, biological evaluation, 3D-QSAR studies of novel aryl-2H-pyrazole derivatives as telomerase inhibitors.

Nanjing University
51
Hit to Lead optimization of a novel class of squarate-containing polo-like kinases inhibitors.

Abbott Laboratories
37
Structure- and property-based design of aminooxazoline xanthenes as selective, orally efficacious, and CNS penetrable BACE inhibitors for the treatment of Alzheimer's disease.

Amgen
10
2-(4-Chlorophenyl)-2-oxoethyl 4-benzamidobenzoate derivatives, a novel class of SENP1 inhibitors: Virtual screening, synthesis and biological evaluation.

Shanghai Jiao Tong University
21
A Potent and Orally Efficacious, Hydroxyethylamine-Based Inhibitor of -Secretase.

TBA
35
Discovery and SAR of orally efficacious tetrahydropyridopyridazinone PARP inhibitors for the treatment of cancer.

Abbott Laboratories
2
Synthesis and evaluation of 2-[2-(phenylthiomethyl)-1H-benzo[d] imidazol-1-yl)acetohydrazide derivatives as antitumor agents.

Sichuan University
14
Profiling Protein Arginine Deiminase 4 (PAD4): a novel screen to identify PAD4 inhibitors.

University of South Carolina
37
Design, synthesis and biological evaluation of pyrazolyl-thiazolinone derivatives as potential EGFR and HER-2 kinase inhibitors.

Nanjing University
25
Design, synthesis and biological evaluation of pyridine acyl sulfonamide derivatives as novel COX-2 inhibitors.

Nanjing University
18
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.

The Scripps Research Institute
32
Metronidazole acid acyl sulfonamide: a novel class of anticancer agents and potential EGFR tyrosine kinase inhibitors.

Nanjing University
36
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).

Amgen
4
Synthesis and biological evaluation of piperamide analogues as HDAC inhibitors.

East China Normal University
6
Discovery of vinylogous carbamates as a novel class ofß-ketoacyl-acyl carrier protein synthase III (FabH) inhibitors.

Soochow University
7
Design, synthesis, and structure-activity relationships of pyrazole derivatives as potential FabH inhibitors.

Nanjing University
30
Optimization of phenyl-substituted benzimidazole carboxamide poly(ADP-ribose) polymerase inhibitors: identification of (S)-2-(2-fluoro-4-(pyrrolidin-2-yl)phenyl)-1H-benzimidazole-4-carboxamide (A-966492), a highly potent and efficacious inhibitor.

Abbott Laboratories
8
Stereochemistry-activity relationship of orally active tetralin S1P agonist prodrugs.

Biogen Idec
17
Discovery and SAR of substituted 3-oxoisoindoline-4-carboxamides as potent inhibitors of poly(ADP-ribose) polymerase (PARP) for the treatment of cancer.

Abbott Laboratories
23
Synthesis and evaluation of a new generation of orally efficacious benzimidazole-based poly(ADP-ribose) polymerase-1 (PARP-1) inhibitors as anticancer agents.

Abbott Laboratories
23
Synthesis and SAR of novel tricyclic quinoxalinone inhibitors of poly(ADP-ribose)polymerase-1 (PARP-1).

Abbott Laboratories
31
Synthesis and SAR of novel, potent and orally bioavailable benzimidazole inhibitors of poly(ADP-ribose) polymerase (PARP) with a quaternary methylene-amino substituent.

Abbott Laboratories
39
Discovery, synthesis, and biological mechanism evaluation of novel quinoline derivatives as potent NLRP3 inhibitors.

Guangzhou Medical University
2
STATs, promising targets for the treatment of autoimmune and inflammatory diseases.

Sichuan University
32
Autophagy modulation in cancer therapy: Challenges coexist with opportunities.

Sichuan University
28
Discovery of Novel Bifunctional Agents as Potent Androgen Receptor Antagonists and Degraders for the Treatment of Enzalutamide-Resistant Prostate Cancer.

China Pharmaceutical University
40
Structure-Guided Optimization and Preclinical Evaluation of 6-O-Benzylguanine-Based Pin1 Inhibitor for Hepatocellular Carcinoma Treatment.

Sichuan University
3
Design, synthesis, and biological evaluation of novel penindolone derivatives as potential inhibitors of hemagglutinin-mediated membrane fusion.

Ocean University of China
60
Rational Design of a Novel Class of Human ClpP Agonists through a Ring-Opening Strategy with Enhanced Antileukemia Activity.

Sichuan University
2
Novel inhibitors targeting the PGK1 metabolic enzyme in glycolysis exhibit effective antitumor activity against kidney renal clear cell carcinoma in vitro and in vivo.

Sichuan University
50
Discovery of (2S)-N-(6-Cyano-5-(trifluoromethyl)pyridin-3-yl)-3-(6-(4-cyanophenyl)-3,6-diazabicyclo[3.1.1]heptan-3-yl)-2-hydroxy-2-methylpropanamide as a Highly Potent and Selective Topical Androgen Receptor Antagonist for Androgenetic Alopecia Treatment.

China Pharmaceutical University
27
Design, Synthesis, and Biological Evaluation of 5-(5-Iodo-2-isopropyl-4-methoxyphenoxy)pyrimidine-2,4-diamine (AF-353) Derivatives as Novel DHFR Inhibitors against Staphylococcus aureus.

Sichuan University
3
Discovery of a Novel Series of Homo sapiens Caseinolytic Protease P Agonists for Colorectal Adenocarcinoma Treatment via ATF3-Dependent Integrated Stress Response.

Sichuan University
19
Facilitating the development of molecular glues: Opportunities from serendipity and rational design.

Sichuan University
2
Discovery of 5-(Piperidin-4-yl)-1,2,4-oxadiazole Derivatives as a New Class of Human Caseinolytic Protease P Agonists for the Treatment of Hepatocellular Carcinoma.

Sichuan University
31
Discovery and Optimization of Novel SaFabI Inhibitors as Specific Therapeutic Agents for MRSA Infection.

Sichuan University
61
Exploration of novel isoxazole-fused quinone derivatives as anti-colorectal cancer agents through inhibiting STAT3 and elevating ROS level.

Sichuan University
22
Discovery and Optimization of Novel

Sichuan University
2
Strategies for the Discovery of Oxazolidinone Antibacterial Agents: Development and Future Perspectives.

Sichuan University
1
Structure-Activity Relationship of Novel Pyrimidine Derivatives with Potent Inhibitory Activities against

Sichuan University
11
Discovery and Mechanistic Study of Novel

Sichuan University
2
Pioneering 4,11-Dioxo-4,11-dihydro-1

Shanghai Jiao Tong University
21
Discovery of a dual-acting inhibitor of interleukin-1β and STATs for the treatment of inflammatory bowel disease.

Guangzhou Medical University
17
Discovery of potent human dihydroorotate dehydrogenase inhibitors based on a benzophenone scaffold.

Sichuan University
18
Therapeutic potential of targeting kynurenine pathway in neurodegenerative diseases.

Shaoxing University
25
Dihydrofolate reductase inhibitors for use as antimicrobial agents.

Sichuan University
4
Repurposed drug candidates for antituberculosis therapy.

Sichuan University
59
Discovery of a Novel Series of Imipridone Compounds as

Sichuan University
18
Synthesis of miltirone analogues as inhibitors of Cdc25 phosphatases.

Graduate School of Chinese Academy of Sciences
2
Design, synthesis, and antitumor activity evaluation of novel acyl sulfonamide spirodienones.

Sichuan University
32
A novel series of teriflunomide derivatives as orally active inhibitors of human dihydroorotate dehydrogenase for the treatment of colorectal carcinoma.

Sichuan University
3
Discovery and Mechanistic Study of

Sichuan University
27
Design, synthesis, and biological activity of potent and selective inhibitors of mast cell tryptase.

Aventis Pharmaceuticals
19
Design, Synthesis, and Biological Evaluation of a Novel Series of Teriflunomide Derivatives as Potent Human Dihydroorotate Dehydrogenase Inhibitors for Malignancy Treatment.

Sichuan University
1
Structure-Guided Design of the First Noncovalent Small-Molecule Inhibitor of CRM1.

Sichuan University and Collaborative Innovation Centre of Biotherapy
23
Discovery of 3-aryl substituted benzoxaboroles as broad-spectrum inhibitors of serine- and metallo-β-lactamases.

Sichuan University
10
Structural modifications on indole and pyrimidine rings of osimertinib lead to high selectivity towards L858R/T790M double mutant enzyme and potent antitumor activity.

Southeast University
5
Discovery of First-In-Class Potent and Selective Tropomyosin Receptor Kinase Degraders.

Cullgen (Shanghai)
4
Sensitive fluorogenic substrates for sirtuin deacylase inhibitor discovery.

Xihua University
21
Glutamyl-gamma-boronate inhibitors of bacterial Glu-tRNA(Gln) amidotransferase.

Dupont Pharmaceuticals
61
Bifunctional Naphtho[2,3-

Sichuan University
3
Design, Synthesis, and Biological Evaluation of Substituted Pyrimidines as Potential Phosphatidylinositol 3-Kinase (PI3K) Inhibitors.

Sun Yat-Sen University
9
Discovery of Novel Peptidomimetic Boronate ClpP Inhibitors with Noncanonical Enzyme Mechanism as Potent Virulence Blockers

Sichuan University
1
A novel series of napabucasin derivatives as orally active inhibitors of signal transducer and activator of transcription 3 (STAT3).

Sichuan University
6
Discovery of 4-piperazinyl-2-aminopyrimidine derivatives as dual inhibitors of JAK2 and FLT3.

Shenyang Pharmaceutical University
6
Discovery of Selective Small Molecule Degraders of BRAF-V600E.

Cullgen
22
Design, synthesis and structure-activity relationship study of aminopyridine derivatives as novel inhibitors of Janus kinase 2.

East China University of Science & Technology
16
Optimization of substituted cinnamic acyl sulfonamide derivatives as tubulin polymerization inhibitors with anticancer activity.

Second Military Medical University
23
Proteases and Their Modulators in Cancer Therapy: Challenges and Opportunities.

Sichuan University
13
Design, synthesis, and structure-activity relationships of novel imidazo[4,5-c]pyridine derivatives as potent non-nucleoside inhibitors of hepatitis C virus NS5B.

Shenyang Pharmaceutical University
2
Application of covalent modality in proximity-induced drug pharmacology: Early development, current strategy, and feature directions.

Sichuan University
29
Discovery of N-((3R,4R)-4-Fluoro-1-(6-((3-methoxy-1-methyl-1H-pyrazol-4-yl)amino)-9-methyl-9H-purin-2-yl)pyrrolidine-3-yl)acrylamide (PF-06747775) through Structure-Based Drug Design: A High Affinity Irreversible Inhibitor Targeting Oncogenic EGFR Mutants with Selectivity over Wild-Type EGFR.

Wuxi Apptec
12
Synthesis and biological evaluation of aurora kinases inhibitors based on N-trisubstituted pyrimidine scaffold.

Sun Yat-Sen University
3
Discovery of novel anti-tuberculosis agents with pyrrolo[1,2-a]quinoxaline-based scaffold.

West China Hospital
19
Compound as cyclin-dependent kinase 9 inhibitor and use thereof

CSPC Zhongqi Pharmaceutical Technology (Shijiazhuang)
9
NOVEL BENZOTHIOPHENE DERIVATIVE AND USE THEREOF AS BET INHIBITOR

Benobio Co.
1
Pyrrolopyrimidine compound and use thereof

Guangzhou Joyo Pharmatech
7
FAK DEGRADERS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS

Berrybio (Shanghai)
32
INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF

Japan Tobacco
2
SHP2 phosphatase allosteric inhibitor

Beijing Shenogen Pharma Group
26
JAK1 PATHWAY INHIBITORS FOR THE TREATMENT OF ASTHMA

Incyte
345
6-AMINOPYRAZOLOPYRIMIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF

Japan Tobacco
592
Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of heart failure and disorders related thereto

Arena Pharmaceuticals
21
1H-IMIDAZO [4,5-H] QUINAZOLINE COMPOUND AS NOVEL SELECTIVE FLT3 INHIBITORS

Shengke Pharmaceuticals (Jiangsu)
30
Dual mode of action soluble guanylate cyclase activators and phosphodiesterase inhibitors and uses thereof

Topadur Pharma
127
Bicyclic hydroxamic acids useful as inhibitors of mammalian histone deacetylase activity

Kancera
3
3-oxa-8-azabicyclo[3.2.1]octane derivatives and their use in the treatment of cancer and hemoglobinopathies

Ctxt
268
Tricyclic sulfones as ROR gamma modulators

Bristol Myers Squibb
12
IDO inhibitors

Bristol Myers Squibb
21
Benzyl-1H-pyrazolo[3,4-b]pyridines and use thereof

Bayer
12
Nuclear receptor binding agents

Gtx
300
Therapeutic thiophene-, furan-, and pyridine-fused azolopyrimidin-5-(6h)-ones

Dart Neuroscience (Cayman)
6
Organic compounds

Intra-Cellular Therapies
84
Fused pyrimidine compound or salt thereof

Taiho Pharmaceutical
145
Quinazolinone compounds and derivatives thereof

Amgen
63
3-cyclohexenyl and cyclohexyl substituted indole and indazole compounds as RORgammaT inhibitors and uses thereof

Merck Sharp & Dohme
30
Dihydroquinoline-2-one derivatives

Hoffmann-La Roche
81
Pyrrolotriazinone derivatives as PI3K inhibitors

Almirall
29
Design, synthesis, and biological activity of thiazole derivatives as novel influenza neuraminidase inhibitors.

Shandong University
11
Effects of some drugs on human erythrocyte glucose 6-phosphate dehydrogenase: an in vitro study.

Ataturk University
2
Affinity Selection-Mass Spectrometry Identifies a Novel Antibacterial RNA Polymerase Inhibitor.

Merck
6
Pyridine and piperidine derivatives as novel sodium channel blockers

Purdue Pharma
2
SF2312 is a natural phosphonate inhibitor of enolase.

University of Texas M. D. Anderson Cancer Center
101
Bicyclic pyridazine compounds as Pim inhibitors

Amgen
22
Heteroaryl compounds as sodium channel blockers

Purdue Pharma
190
Chemical compounds 542

AstraZeneca
3
Steady-state kinetic and inhibition studies of the mammalian target of rapamycin (mTOR) kinase domain and mTOR complexes.

Pfizer
31
5-Amidinobenzo[b]thiophenes as dual inhibitors of factors IXa and Xa.

Bristol Myers Squibb
21
Anticholinesterase activity of compounds related to geneserine tautomers. N-Oxides and 1,2-oxazines.

National Institutes of Health
3
Methylxanthine drugs are chitinase inhibitors: investigation of inhibition and binding modes.

University of Dundee
39
9-Amino-1,2,3,4-tetrahydroacridin-1-ols: synthesis and evaluation as potential Alzheimer's disease therapeutics.

Hoechst-Roussel Pharmaceuticals
26
2-Aminoquinazoline inhibitors of cyclin-dependent kinases.

Naeja Pharmaceutical
18
The discovery of N-(1,3-thiazol-2-yl)pyridin-2-amines as potent inhibitors of KDR kinase.

Merck Research Laboratories
19
Optimization of the indolyl quinolinone class of KDR (VEGFR-2) kinase inhibitors: effects of 5-amido- and 5-sulphonamido-indolyl groups on pharmacokinetics and hERG binding.

Merck Research Laboratories
17
Discovery and evaluation of 3-(5-thien-3-ylpyridin-3-yl)-1H-indoles as a novel class of KDR kinase inhibitors.

Merck Research Laboratories