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.

75 articles for X Song


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

PMID
Data
Article Title
Organization
Structure-guided design of a series of MCL-1 inhibitors with high affinity and selectivity.EBI
Abbvie
Synthesis and Structure-Activity Relationship Study of 5a-Carbasugar Analogues of SL0101.EBI
Northeastern University
Design and synthesis of 1-aryl-5-anilinoindazoles as c-Jun N-terminal kinase inhibitors.EBI
The Scripps Research Institute
Small molecule tertiary amines as agonists of the nuclear hormone receptor Rev-erba.EBI
The Scripps Research Institute
Disubstituted piperidines as potent orexin (hypocretin) receptor antagonists.EBI
Scripps Florida
Synthesis and SAR of tetrahydroisoquinolines as Rev-erba agonists.EBI
The Scripps Research Institute
Synthesis, biological evaluation, X-ray structure, and pharmacokinetics of aminopyrimidine c-jun-N-terminal kinase (JNK) inhibitors.EBI
Translational Research Institute
Amino acid ester prodrugs of the antiviral agent 2-bromo-5,6-dichloro-1-(beta-D-ribofuranosyl)benzimidazole as potential substrates of hPEPT1 transporter.EBI
University of Michigan
Imidazopyridines as selective CYP3A4 inhibitors.EBI
The Scripps Research Institute
Synthesis and SAR of 2-phenoxypyridines as novel c-Jun N-terminal kinase inhibitors.EBI
The Scripps Research Institute
N-aryl-benzimidazolones as novel small molecule HSP90 inhibitors.EBI
Abbott Laboratories
Synthesis and SAR of 4-(pyrazol-3-yl)-pyridines as novel c-jun N-terminal kinase inhibitors.EBI
The Scripps Research Institute
Synthesis and SAR of novel quinazolines as potent and brain-penetrant c-jun N-terminal kinase (JNK) inhibitors.EBI
The Scripps Research Institute
ApoA-I mimetic peptides promote pre-ß HDL formation in vivo causing remodeling of HDL and triglyceride accumulation at higher dose.EBI
Merck Research Laboratories
Discovery of an orally bioavailable small molecule inhibitor of prosurvival B-cell lymphoma 2 proteins.EBI
Abbott Laboratories
Assessment of the structure-activity relationship and antileukemic activity of diacylpyramide compounds as human ClpP agonists.EBI
University of Chinese Academy of Sciences
An Adenosine Analogue Library Reveals Insights into Active Sites of Protein Arginine Methyltransferases and Enables the Discovery of a Selective PRMT4 Inhibitor.EBI
Purdue University
Distinct Amino Acid-Based PROTACs Target Oncogenic Kinases for Degradation in Non-Small Cell Lung Cancer (NSCLC).EBI
Southern University of Science and Technology
Discovery of novel benzimidazole derivatives as selective and reversible monoamine oxidase B inhibitors for Parkinson's disease treatment.EBI
Zhejiang University
Discovery of 6-Formylpyridyl Urea Derivatives as Potent Reversible-Covalent Fibroblast Growth Factor Receptor 4 Inhibitors with Improved Anti-Hepatocellular Carcinoma Activity.EBI
Jinan University
Discovery of the Clinical Candidate Sonrotoclax (BGB-11417), a Highly Potent and Selective Inhibitor for Both WT and G101V Mutant Bcl-2.EBI
BeiGene(Beiing) Co., Ltd.
Switch type I to type II TRK inhibitors for combating clinical resistance induced by xDFG mutation for cancer therapy.EBI
Jinan University
Structure-Based Optimization of the Third Generation Type II Macrocycle TRK Inhibitors with Improved Activity against Solvent-Front, xDFG, and Gatekeeper Mutations.EBI
Jinan University
Rational Design of Covalent Kinase Inhibitors by an Integrated Computational Workflow (Kin-Cov).EBI
Jinan University
Identification of (S)-1-(2-(2,4-difluorophenyl)-4-oxothiazolidin-3-yl)-3-(4-((7-(3-(4-ethylpiperazin-1-yl)propoxy)-6-methoxyquinolin-4-yl)oxy)-3,5-difluorophenyl)urea as a potential anti-colorectal cancer agent.EBI
Zunyi Medical University
Chemical tools for the Gid4 subunit of the human E3 ligase C-terminal to LisH (CTLH) degradation complex.EBI
University of Toronto
Design, synthesis and biological evaluation of EGFR kinase inhibitors that spans the orthosteric and allosteric sites.EBI
Zunyi Medical University
Discovery of BGB-8035, a Highly Selective Covalent Inhibitor of Bruton's Tyrosine Kinase for B-Cell Malignancies and Autoimmune Diseases.EBI
Beigene (Beijing) Co.
1-Methyl-3-((4-(quinolin-4-yloxy)phenyl)amino)-1H-pyrazole-4-carboxamide derivatives as new rearranged during Transfection (RET) kinase inhibitors capable of suppressing resistant mutants in solvent-front regions.EBI
Jinan University
A comprehensive overview of β-carbolines and its derivatives as anticancer agents.EBI
Xinyang Normal University
Design, Synthesis, and Biological Evaluation of 5-Formyl-pyrrolo[3,2-EBI
Jinan University
Discovery of the First Highly Selective and Broadly Effective Macrocycle-Based Type II TRK Inhibitors that Overcome Clinically Acquired Resistance.EBI
Jinan University
Design, Synthesis, and Biological Evaluation of Aminoindazole Derivatives as Highly Selective Covalent Inhibitors of Wild-Type and Gatekeeper Mutant FGFR4.EBI
Jinan University
Discovery of Hexahydrofuro[3,2-EBI
Jinan University
Development of pyrazolo[3,4-d]pyrimidin-4-one scaffold as novel CDK2 inhibitors: Design, synthesis, and biological evaluation.EBI
Beijing University of Technology
Dual target inhibitors based on EGFR: Promising anticancer agents for the treatment of cancers (2017-).EBI
Zhuhai Campus of Zunyi Medical University
Discovery of D6808, a Highly Selective and Potent Macrocyclic c-Met Inhibitor for Gastric Cancer Harboring EBI
Jinan University
Characterization of an aromatic trifluoromethyl ketone as a new warhead for covalently reversible kinase inhibitor design.EBI
Jinan University
Design, Synthesis, and Biological Evaluation of 2-Formyl Tetrahydronaphthyridine Urea Derivatives as New Selective Covalently Reversible FGFR4 Inhibitors.EBI
Jinan University
Discovery of a Brigatinib Degrader SIAIS164018 with Destroying Metastasis-Related Oncoproteins and a Reshuffling Kinome Profile.EBI
Shanghaitech University
Design of Dimeric Bile Acid Derivatives as Potent and Selective Human NTCP Inhibitors.EBI
National Institute of Biological Sciences
Utilization of Metabolite Identification and Structural Data to Guide Design of Low-Dose IDO1 Inhibitors.EBI
Merck
Structure-based discovery of SIAIS001 as an oral bioavailability ALK degrader constructed from Alectinib.EBI
Shanghaitech University
SAR towards indoline and 3-azaindoline classes of IDO1 inhibitors.EBI
Merck
Discovery of A-1331852, a First-in-Class, Potent, and Orally-Bioavailable BCL-XEBI
Abbvie
Investigation of Covalent Warheads in the Design of 2-Aminopyrimidine-based FGFR4 Inhibitors.EBI
Jinan University
Design, synthesis and biological evaluation of novel 2,4-diaryl pyrimidine derivatives as selective EGFREBI
Sun Yat-Sen University
Carbamate and EBI
Merck
Development of a Brigatinib degrader (SIAIS117) as a potential treatment for ALK positive cancer resistance.EBI
Shanghaitech University
Design, synthesis, and biological evaluation of 1,2,5-oxadiazole-3-carboximidamide derivatives as novel indoleamine-2,3-dioxygenase 1 inhibitors.EBI
Chinese Academy of Sciences
Discovery of Potent and Orally Available Bicyclo[1.1.1]pentane-Derived Indoleamine-2,3-dioxygenase 1 (IDO1) Inhibitors.EBI
Merck
Strategic Incorporation of Polarity in Heme-Displacing Inhibitors of Indoleamine-2,3-dioxygenase-1 (IDO1).EBI
Merck
Synthesis and biological evaluation of novel benzo[c][1,2,5]thiadiazol-5-yl and thieno[3,2-c]- pyridin-2-yl imidazole derivatives as ALK5 inhibitors.EBI
Yanbian 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 6-deoxy O-spiroketal C-arylglucosides as novel renal sodium-dependent glucose cotransporter 2 (SGLT2) inhibitors for the treatment of type 2 diabetes.EBI
Chinese Academy of Sciences
Discovery and Pharmacology of a Novel Class of Diacylglycerol Acyltransferase 2 Inhibitors.EBI
Merck
Discovery of carbazole carboxamides as novel RORγt inverse agonists.EBI
Fudan University
From RORγt Agonist to Two Types of RORγt Inverse Agonists.EBI
Fudan University
HETEROARYL-SUBSTITUTED BICYCLIC COMPOUND AND USE THEREOFBDB
Medshine Discovery
ANTI-PD-L1 IMMUNOCONJUGATES, AND USES THEREOFBDB
Bolt Biotherapeutics
Salts and pharmaceutical compositions thereof for the treatment of inflammatory disordersBDB
Galapagos
Nrf2 regulatorsBDB
Glaxosmithkline
Indanylaminopyridylcyclopropanecarboxylic acids, pharmaceutical compositions and uses thereofBDB
Boehringer Ingelheim International
Fused pyrimidine compound or salt thereofBDB
Taiho Pharmaceutical
Acetaldehyde-derived modifications on cytosolic human carbonic anhydrases.BDB
University of Tampere and Tampere University Hospital
Slowly on, Slowly off: Bisubstrate-Analogue Conjugates of 5-Iodotubercidin and Histone H3 Peptide Targeting Protein Kinase Haspin.BDB
University of Tartu
Trisubstituted purine derivativesBDB
Cyclacel
Triazole compounds as KSP inhibitorsBDB
Novartis
Pharmacological characterization of human S1P4 using a novel radioligand, [4,5-3H]-dihydrosphingosine-1-phosphate.BDB
Schering-Plough Research Institute
5HT4(a) and 5-HT4(b) receptors have nearly identical pharmacology and are both expressed in human atrium and ventricle.BDB
University of Oslo
Structural combination of established 5-HT(2A) receptor ligands: new aspects of the binding mode.BDB
University of Mainz
The discovery of N-(1,3-thiazol-2-yl)pyridin-2-amines as potent inhibitors of KDR kinase.BDB
Merck Research Laboratories
Discovery and evaluation of 3-(5-thien-3-ylpyridin-3-yl)-1H-indoles as a novel class of KDR kinase inhibitors.BDB
Merck Research Laboratories