PMID
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Data
Article Title
Organization
35
Discovery of novel BRD4 inhibitors by high-throughput screening, crystallography, and cell-based assays.

Nanchang University
18
Design and synthesis of new potent PTP1B inhibitors with the skeleton of 2-substituted imino-3-substituted-5-heteroarylidene-1,3-thiazolidine-4-one: Part I.

Xi'An Jiaotong University
6
Identification of human telomerase inhibitors having the core of N-acyl-4,5-dihydropyrazole with anticancer effects.

Hefei University of Technology
19
Novel tricyclic pyrazolo[1,5-d][1,4]benzoxazepin-5(6H)-one: Design, synthesis, model and use as hMAO-B inhibitors.

Anhui Medical University
10
Discovery and Optimization of Novel, Selective Histone Methyltransferase SET7 Inhibitors by Pharmacophore- and Docking-Based Virtual Screening.

Shanghai University
23
Design, synthesis and biological evaluation of isoquinoline-based derivatives as novel histone deacetylase inhibitors.

The Walter and Eliza Hall Institute of Medical Research
30
Synthesis and evaluation of C2-carbon-linked heterocyclic-5-hydroxy-6-oxo-dihydropyrimidine-4-carboxamides as HIV-1 integrase inhibitors.

Bristol Myers Squibb
1
Astemizole arrests the proliferation of cancer cells by disrupting the EZH2-EED interaction of polycomb repressive complex 2.

Chinese Academy of Sciences
13
Identifying novel selective non-nucleoside DNA methyltransferase 1 inhibitors through docking-based virtual screening.

Chinese Academy of Sciences
17
Design, synthesis, quantum chemical studies and biological activity evaluation of pyrazole-benzimidazole derivatives as potent Aurora A/B kinase inhibitors.

Xuzhou Medical University
7
Anthraquinone Derivatives as Potent Inhibitors of c-Met Kinase and the Extracellular Signaling Pathway.

Soochow University
26
Design, synthesis, and pharmacological evaluation of monocyclic pyrimidinones as novel inhibitors of PDE5.

Chinese Academy of Sciences
11
Discovery of new non-steroidal FXR ligands via a virtual screening workflow based on Phase shape and induced fit docking.

East China University of Science and Technology
14
Novel thiophene derivatives as PTP1B inhibitors with selectivity and cellular activity.

Chinese Academy of Sciences
15
Structure-activity relationship and enzyme kinetic studies on 4-aryl-1H-1,2,3-triazoles as indoleamine 2,3-dioxygenase (IDO) inhibitors.

Fudan University
161
Identification of pentacyclic triterpenes derivatives as potent inhibitors against glycogen phosphorylase based on 3D-QSAR studies.

Chinese Academy of Sciences
12
Identification and synthesis of N'-(2-oxoindolin-3-ylidene)hydrazide derivatives against c-Met kinase.

Chinese Academy of Sciences
25
Structural Optimization of Next-Generation TRK Inhibitors against Acquired Drug Resistance Mutations for the Treatment of Solid Tumors.

Shanghai Institute of Materia Medica
24
Discovery of 3-(Fluoro-imidazolyl)pyridazine Derivatives as Potent STING Agonists with Antitumor Activity.

Chinese Academy of Sciences
36
Harnessing the Magic Methyl Effect: Discovery of CLPP-2068 as a Novel HsClpP Activator for the Treatment of Diffuse Large B-Cell Lymphoma.

Shanghai Institute of Materia Medica
1
Synthesis, biological evaluation and mechanism study of a novel indole-pyridine chalcone derivative as antiproliferative agent against tumor cells through dual targeting tubulin and HK2.

Huazhong University of Science and Technology
41
Design, synthesis, and structure-activity relationship studies of triazolo-pyrimidine derivatives as WRN inhibitors for the treatment of MSI tumors.

Shanghai Institute of Materia Medica
2
AST1306, a novel irreversible inhibitor of the epidermal growth factor receptor 1 and 2, exhibits antitumor activity both in vitro and in vivo.

Shanghai Institute of Materia Medica
5
Targeting polyketide synthase 13 for the treatment of tuberculosis.

China Pharmaceutical University
36
Discovery of Imidazo[1,2-a]pyrazine Derivatives as Potent ENPP1 Inhibitors.

Shanghai Institute of Materia Medica
22
Discovery of a Potent and Orally Bioavailable Xanthine Oxidase/Urate Transporter 1 Dual Inhibitor as a Potential Treatment for Hyperuricemia and Gout.

HEC Research and Development Center
20
Multimechanism biological profiling of tetrahydro-β-carboline analogues as selective HDAC6 inhibitors for the treatment of Alzheimer's disease.

Northwest A&F University
26
Discovery, Optimization, and Evaluation of Novel Pyridin-2(1H)-one Analogues as Potent TRK Inhibitors for Cancer Treatment.

Shanghai Tech University
2
Design, Synthesis, and Biological Evaluation of Potent and Selective PROTAC Degraders of Oncogenic KRASG12D.

Shanghai Institute of Materia Medica
45
Discovery of potent and selective c-Met inhibitors for MET-amplified hepatocellular carcinoma treatment.

China Pharmaceutical University
57
Discovery of Novel Nonpeptidic and Noncovalent Small Molecule 3CLpro Inhibitors as anti-SARS-CoV-2 Drug Candidate.

University of Chinese Academy of Sciences
4
Design, synthesis, and bioevaluation of SOS1 PROTACs derived from pyrido[2,3-d]pyrimidin-7-one-based SOS1 inhibitor.

Nanjing University of Chinese Medicine
47
Discovery of Potent, Selective, and Orally Bioavailable DYRK2 Inhibitors for the Treatment of Prostate Cancer.

China Pharmaceutical University
22
Structure-Activity Relationship Study of 1

University of Chinese Academy of Sciences
39
Synthesis and Biological Evaluation of β-Lactam Derivatives Targeting Speckle-Type POZ Protein (SPOP).

Nanjing University of Chinese Medicine
12
Indole derivatives as potent inhibitors of 5-lipoxygenase: design, synthesis, biological evaluation, and molecular modeling.

Chinese Academy of Sciences
49
Discovery of Potent and Wild-Type-Sparing Fourth-Generation EGFR Inhibitors for Treatment of Osimertinib-Resistance NSCLC.

China Pharmaceutical University
28
Design, Synthesis, and Biological Evaluation of Bipyridazine Derivatives as Stimulator of Interferon Genes (STING) Receptor Agonists.

Fudan University
8
Discovery of a Potent, Cooperative, and Selective SOS1 PROTAC ZZ151 with In Vivo Antitumor Efficacy in KRAS-Mutant Cancers.

Shanghai Institute of Materia Medica
28
Structural Optimization of Fibroblast Growth Factor Receptor Inhibitors for Treating Solid Tumors.

Shanghai Institute of Materia Medica
33
Discovery of Potent DYRK2 Inhibitors with High Selectivity, Great Solubility, and Excellent Safety Properties for the Treatment of Prostate Cancer.

China Pharmaceutical University
25
Design, Synthesis, and Bioevaluation of Pyrido[2,3-

Nanjing University of Chinese Medicine
1
Discovery of the First-in-Class Agonist-Based SOS1 PROTACs Effective in Human Cancer Cells Harboring Various KRAS Mutations.

Shanghai Institute of Materia Medica
22
Design, synthesis and structure-activity relationship studies of pyrido[2,3-d]pyrimidin-7-ones as potent Janus Kinase 3 (JAK3) covalent inhibitors.

Chinese Academy of Sciences
30
Discovery, Optimization, and Evaluation of Selective CDK4/6 Inhibitors for the Treatment of Breast Cancer.

China Pharmaceutical University
47
Discovery of Dual CDK6/PIM1 Inhibitors with a Novel Structure, High Potency, and Favorable Druggability for the Treatment of Acute Myeloid Leukemia.

China Pharmaceutical University
4
Rational Design and Synthesis of Novel Dual PROTACs for Simultaneous Degradation of EGFR and PARP.

Huazhong University of Science and Technology
10
Discovery of Pyrazolo[3,4-

Bytedance Ai Lab
2
Stapled Peptides Targeting SARS-CoV-2 Spike Protein HR1 Inhibit the Fusion of Virus to Its Cell Receptor.

Second Military Medical University
2
Discovery of Cyclic Peptidomimetic Ligands Targeting the Extracellular Domain of EGFR.

University of South Florida
2
Discovery of a potent, selective, and covalent ZAP-70 kinase inhibitor.

University of Chinese Academy of Science
2
Withanolides from dietary tomatillo suppress HT1080 cancer cell growth by targeting mutant IDH1.

Shenyang Pharmaceutical University
7
Automated design and optimization of multitarget schizophrenia drug candidates by deep learning.

Shanghai Institute of Materia Medica
2
Discovery of an Orally Active Small-Molecule Tumor Necrosis Factor-α Inhibitor.

Huazhong University of Science and Technology
3
Heterocycle amide isosteres: An approach to overcoming resistance for HIV-1 integrase strand transfer inhibitors.

Bristol Myers Squibb
42
Rational design of 5-((1H-imidazol-1-yl)methyl)quinolin-8-ol derivatives as novel bromodomain-containing protein 4 inhibitors.

Chinese Academy of Sciences
35
Discovery of Highly Potent, Selective, and Orally Efficacious p300/CBP Histone Acetyltransferases Inhibitors.

Chinese Academy of Sciences
14
Discovery and Development of a Series of Pyrazolo[3,4-

Shanghai University
9
Discovery of Novel Disruptor of Silencing Telomeric 1-Like (DOT1L) Inhibitors using a Target-Specific Scoring Function for the (S)-Adenosyl-l-methionine (SAM)-Dependent Methyltransferase Family.

Chinese Academy of Sciences
22
Structure-based design and synthesis of C-1- and C-4-modified analogs of zanamivir as neuraminidase inhibitors.

Chinese Academy of Sciences
39
Nitrogen-appended N-alkylsulfonamides as inhibitors of gamma-secretase.

Bristol Myers Squibb
55
Amino-caprolactam derivatives as gamma-secretase inhibitors.

Bristol Myers Squibb
29
Discovery of (S)-2-((S)-2-(3,5-difluorophenyl)-2-hydroxyacetamido)-N-((S,Z)-3-methyl-4-oxo-4,5-dihydro-3H-benzo[d][1,2]diazepin-5-yl)propanamide (BMS-433796): a gamma-secretase inhibitor with Abeta lowering activity in a transgenic mouse model of Alzheimer's disease.

Bristol Myers Squibb
47
N-(5-chloro-2-(hydroxymethyl)-N-alkyl-arylsulfonamides as gamma-secretase inhibitors.

Bristol Myers Squibb
2
Docking based design of diastereoisomeric MTCA as GPIIb/IIIa receptor inhibitor.

Capital Medical University
3
Discovery of the Human Immunodeficiency Virus Type 1 (HIV-1) Attachment Inhibitor Temsavir and Its Phosphonooxymethyl Prodrug Fostemsavir.

TBA
16
The discovery and preclinical evaluation of BMS-707035, a potent HIV-1 integrase strand transfer inhibitor.

Bristol Myers Squibb
35
Design, Synthesis, and Pharmacological Evaluation of Novel Multisubstituted Pyridin-3-amine Derivatives as Multitargeted Protein Kinase Inhibitors for the Treatment of Non-Small Cell Lung Cancer.

University of Chinese Academy of Sciences
7
Hexone glucokinase inhibitor and use thereof

Shandong Xuanzhu Pharma Co.
3
Glucopyranosyl derivatives and their uses

Sunshine Lake Pharma
11
USE OF HPK1 INHIBITOR IN TREATMENT OF INTERFERON-RELATED DISEASES

Asclepieion Pharmaceutical
129
Substituted 7-(Pyrimidin-4-yl)Quinolin-4(1H)-One Compounds as Cyclin Dependent Kinase Inhibitors

Beigene
20
4-(2-PYRAZOLO[3,4-B]PYRIDINE-5-YL)ETHYNYL-2-PYRIDINE DERIVATIVES USEFUL AS GCN2 INHIBITORS

IP2IPO Innovations
46
MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE

Neurocrine Biosciences
1044
SARS-COV2 MAIN PROTEASE INHIBITORS

Gilead Sciences
3
COMBINATION THERAPY

Pfizer
24
3-(Indol-2-yl)indazoles as Chek1 kinase inhibitors: Optimization of potency and selectivity via substitution at C6.

Merck Research Laboratories