cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2zg6wm7
title: BindingDB Entry 50008548: Fragment-to-Lead Medicinal Chemistry Publications in 2018.

description: Small molecule binding data for protein Beta-2 adrenergic receptor, CREB-binding protein, Dual specificity tyrosine-phosphorylation-regulated kinase 1A, GTPase HRas, Glycylpeptide N-tetradecanoyltransferase 1, and cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, Uniprot P01112, P07550, P30419, Q13627, Q92793, and Q9Y233
DOI: 10.7270/q2zg6wnp
title: BindingDB Entry 50009206: Structure-based drug design, synthesis, In vitro, and In vivo biological evaluation of indole-based biomimetic analogs targeting estrogen receptor-α inhibition.

description: Small molecule binding data for protein Estrogen receptor, Uniprot P03372
DOI: 10.7270/q2zg6wp4
title: BindingDB Entry 50009824: Optically Pure, Structural, and Fluorescent Analogues of a Dimeric Y4 Receptor Agonist Derived by an Olefin Metathesis Approach.

description: Small molecule binding data for protein Neuropeptide Y receptor type 1 and Neuropeptide Y receptor type 4, Uniprot P25929 and P50391
DOI: 10.7270/q2zg6wqk
title: BindingDB Entry 50010139: Identification and immunological evaluation of novel TLR2 agonists through structure optimization of Pam

description: Small molecule binding data for protein Toll-like receptor 2, Uniprot Q9QUN7
DOI: 10.7270/q2zg6wr1
title: BindingDB Entry 50010398: Discovery of Lanraplenib (GS-9876): A Once-Daily Spleen Tyrosine Kinase Inhibitor for Autoimmune Diseases.

description: Small molecule binding data for protein Tyrosine-protein kinase JAK2 and Tyrosine-protein kinase SYK, Uniprot O60674 and P43405
DOI: 10.7270/q2zg6wsg
title: BindingDB Entry 50010718: A new series of aryl sulfamate derivatives: Design, synthesis, and biological evaluation.

description: Small molecule binding data for protein Steryl-sulfatase, Uniprot P08842
DOI: 10.7270/q2zg6wtx
title: BindingDB Entry 50011347: Discovery of VU6027459: A First-in-Class Selective and CNS Penetrant mGlu

description: Small molecule binding data for protein Metabotropic glutamate receptor 1, Metabotropic glutamate receptor 2, Metabotropic glutamate receptor 3, Metabotropic glutamate receptor 4, Metabotropic glutamate receptor 5, Metabotropic glutamate receptor 7, Metabotropic glutamate receptor 8, Sigma non-opioid intracellular receptor 1, and Sodium-dependent dopamine transporter, Uniprot O00222, P35400, P41594, Q01959, Q13255, Q14416, Q14832, Q14833, and Q99720
DOI: 10.7270/q2zg6wvc
title: BindingDB Entry 50011989: Development of potent CPP6-gemcitabine conjugates against human prostate cancer cell line (PC-3).

description: Small molecule binding data for protein Equilibrative nucleoside transporter 1, Uniprot Q99808
DOI: 10.7270/q2zg6wwt
title: BindingDB Entry 50012606: Structure-Activity Relationships of [des-Arg

description: Small molecule binding data for protein Delta-type opioid receptor, Kappa-type opioid receptor, and Mu-type opioid receptor, Uniprot P35372, P41143, and P41145
DOI: 10.7270/q2zg6wx8
title: BindingDB Entry 50012935: Brain Penetrable Inhibitors of Ceramide Galactosyltransferase for the Treatment of Lysosomal Storage Disorders.

description: Small molecule binding data for protein 2-hydroxyacylsphingosine 1-beta-galactosyltransferase, UDP-glucuronosyltransferase 1-6, UDP-glucuronosyltransferase 1A1, UDP-glucuronosyltransferase 2B15, UDP-glucuronosyltransferase 2B17, and UDP-glucuronosyltransferase 2B7, Uniprot O75795, P16662, P19224, P22309, P54855, Q16880, and Q64676
DOI: 10.7270/q2zg6wzq
title: BindingDB Entry 50013239: Discovery of a Novel Highly Selective Histamine H4 Receptor Antagonist for the Treatment of Atopic Dermatitis.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 3A, Histamine H3 receptor, and Histamine H4 receptor, Uniprot P46098, Q91ZY2, Q9H3N8, and Q9Y5N1
DOI: 10.7270/q2zg6x0k
title: BindingDB Entry 50013571: Design and synthesis of 1H-pyrazolo[3,4-b]pyridines targeting mitogen-activated protein kinase kinase 4 (MKK4) - A promising target for liver regeneration.

description: Small molecule binding data for protein Dual specificity mitogen-activated protein kinase kinase 4, Dual specificity mitogen-activated protein kinase kinase 7, Mitogen-activated protein kinase 8, Mitogen-activated protein kinase kinase kinase 20, Mitogen-activated protein kinase kinase kinase kinase 5, and Serine/threonine-protein kinase B-raf, Uniprot O14733, P15056, P45983, P45985, Q9NYL2, and Q9Y4K4
DOI: 10.7270/q2zg6x11
title: BindingDB Entry 50013884: Discovery of antiproliferative and anti-FAK inhibitory activity of 1,2,4-triazole derivatives containing acetamido carboxylic acid skeleton.

description: Small molecule binding data for protein Focal adhesion kinase 1, Uniprot Q05397
DOI: 10.7270/q2zg6x2g
title: BindingDB Entry 50014244: Discovery of

description: Small molecule binding data for protein Activin receptor type-1, Cyclin-A2/Cyclin-dependent kinase 2, Cyclin-C, Cyclin-H/Cyclin-dependent kinase 7, Cyclin-K/Cyclin-dependent kinase 13, Cyclin-T1/Cyclin-dependent kinase 9, Cyclin-Y/Cyclin-dependent kinase 16, Cyclin-dependent kinase 12, Cyclin-dependent kinase 3/G1/S-specific cyclin-E1, Cyclin-dependent kinase 4/G1/S-specific cyclin-D1, Cyclin-dependent kinase 5 activator 1, Cyclin-dependent kinase 6/G1/S-specific cyclin-D3, Cyclin-dependent kinase/G2/mitotic-specific cyclin- 1, Glycogen synthase kinase-3 alpha, Glycogen synthase kinase-3 beta, NT-3 growth factor receptor, Protein kinase C alpha type, and Receptor-type tyrosine-protein kinase FLT3, Uniprot O60563, O75909, P06493, P11802, P14635, P17252, P20248, P24385, P24863, P24864, P24941, P30281, P36888, P49840, P49841, P50613, P50750, P51946, Q00526, Q00534, Q00535, Q00536, Q04771, Q14004, Q15078, Q16288, Q8ND76, and Q9NYV4
DOI: 10.7270/q2zk5kp2
title: BindingDB Entry 9201: Mutant IDH1 inhibitors

description: Small molecule binding data for protein Isocitrate dehydrogenase [NADP] cytoplasmic, Isocitrate dehydrogenase [NADP] cytoplasmic [R132C], and Isocitrate dehydrogenase [NADP] cytoplasmic [R132H], Uniprot O75874
DOI: 10.7270/q2zk5kqh
title: BindingDB Entry 9410: Quinoline analogs as phosphatidylinositol 3-kinase inhibitors

description: Small molecule binding data for protein Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, Uniprot O00329
DOI: 10.7270/q2zk5krz
title: BindingDB Entry 9588: 2,4,5-tri-substituted azole-based casein kinase 1 inhibitors as inducers for cardiomyogenesis

description: Small molecule binding data for protein Casein kinase I isoform delta, Casein kinase I isoform epsilon, and Mitogen-activated protein kinase 14, Uniprot P48730, P49674, and Q16539
DOI: 10.7270/q2zk5ksd
title: BindingDB Entry 9797: Modulators of the sigma-2 receptor and their method of use

description: Small molecule binding data for protein Sigma intracellular receptor 2, Uniprot Q5BJF2
DOI: 10.7270/q2zk5ktv
title: BindingDB Entry 9975: Pyridine derivative as ASK1 inhibitor and preparation method and use thereof

description: Small molecule binding data for protein Mitogen-activated protein kinase kinase kinase 5, Uniprot Q99683
DOI: 10.7270/q2zk5kv9
title: BindingDB Entry 10184: Phenylpyrrolidinone formyl peptide 2 receptor agonists

description: Small molecule binding data for protein N-formyl peptide receptor 2 and fMet-Leu-Phe receptor, Uniprot P21462 and P25090
DOI: 10.7270/q2zk5kwr
title: BindingDB Entry 10571: Heteroaryl[4,3-C]pyrimidine-5-amine derivative, preparation method therefor, and medical uses thereof

description: Small molecule binding data for protein Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A2b, and Adenosine receptor A3, Uniprot P0DMS8, P29274, P29275, and P30542
DOI: 10.7270/q2zk5kx6
title: BindingDB Entry 50006682: Bisubstrate Inhibitors of Nicotinamide

description: Small molecule binding data for protein Nicotinamide N-methyltransferase, Uniprot P40261
DOI: 10.7270/q2zk5kzn
title: BindingDB Entry 50007272: The discovery and optimization of benzimidazoles as selective Na

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Gamma-aminobutyric acid receptor subunit alpha-1/gamma-2, Potassium voltage-gated channel subfamily A member 1, Potassium voltage-gated channel subfamily A member 2, Potassium voltage-gated channel subfamily A member 5, Potassium voltage-gated channel subfamily KQT member 1, Small conductance calcium-activated potassium channel protein 2, Sodium channel protein type 1 subunit alpha, Sodium channel protein type 10 subunit alpha, Sodium channel protein type 2 subunit alpha, Sodium channel protein type 3 subunit alpha, Sodium channel protein type 4 subunit alpha, Sodium channel protein type 5 subunit alpha, Sodium channel protein type 8 subunit alpha, Sodium channel protein type 9 subunit alpha, Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S, and Voltage-dependent T-type calcium channel subunit alpha-1G/alpha-1H/alpha-1I, Uniprot O43497, O60840, O95180, P14867, P16389, P18507, P22460, P35498, P35499, P40989, P51787, Q01668, Q09470, Q13698, Q13936, Q14524, Q15858, Q99250, Q9H2S1, Q9NY46, Q9P0X4, Q9UQD0, and Q9Y5Y9
DOI: 10.7270/q2zk5m0h
title: BindingDB Entry 50007619: Discovery of AM-6494: A Potent and Orally Efficacious β-Site Amyloid Precursor Protein Cleaving Enzyme 1 (BACE1) Inhibitor with in Vivo Selectivity over BACE2.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Beta-secretase 1, Beta-secretase 2, Cathepsin D, Cathepsin E, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, and Renin, Uniprot P00797, P07339, P08684, P10635, P11712, P14091, P40989, P56817, Q9JL18, and Q9Y5Z0
DOI: 10.7270/q2zk5m1z
title: BindingDB Entry 50007884: Novel N-benzylpiperidine carboxamide derivatives as potential cholinesterase inhibitors for the treatment of Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot O42275 and P81908
DOI: 10.7270/q2zk5m2d
title: BindingDB Entry 50008223: 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.

description: Small molecule binding data for protein Sodium/glucose cotransporter 1 and Sodium/glucose cotransporter 2, Uniprot P13866 and P31639
DOI: 10.7270/q2zk5m3v
title: BindingDB Entry 50008871: Discovery of a C-8 hydroxychromene as a potent degrader of estrogen receptor alpha with improved rat oral exposure over GDC-0927.

description: Small molecule binding data for protein Estrogen receptor, Uniprot P03372
DOI: 10.7270/q2zk5m49
title: BindingDB Entry 50009491: 6-Hydrophobic aromatic substituent pyrimethamine analogues as potential antimalarials for pyrimethamine-resistant Plasmodium falciparum.

description: Small molecule binding data for protein Dihydrofolate reductase, Uniprot P00374
DOI: 10.7270/q2zk5m5r
title: BindingDB Entry 50010098: Polar Recognition Group Study of Keap1-Nrf2 Protein-Protein Interaction Inhibitors.

description: Small molecule binding data for protein Nuclear factor erythroid 2-related factor 2, Uniprot Q16236
DOI: 10.7270/q2zk5m66
title: BindingDB Entry 50010667: Discovery of Branebrutinib (BMS-986195): A Strategy for Identifying a Highly Potent and Selective Covalent Inhibitor Providing Rapid in Vivo Inactivation of Bruton's Tyrosine Kinase (BTK).

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Cytoplasmic tyrosine-protein kinase BMX, Epidermal growth factor receptor, Receptor tyrosine-protein kinase erbB-4, Tyrosine-protein kinase BTK, Tyrosine-protein kinase ITK/TSK, Tyrosine-protein kinase TXK, and Tyrosine-protein kinase Tec, Uniprot P00533, P40989, P42680, P42681, P51813, Q06187, Q08881, and Q15303
DOI: 10.7270/q2zk5m7n
title: BindingDB Entry 50011016: Design, synthesis and biological evaluation of potent EGFR kinase inhibitors against 19D/T790M/C797S mutation.

description: Small molecule binding data for protein Epidermal growth factor receptor, Uniprot P00533
DOI: 10.7270/q2zk5m83
title: BindingDB Entry 50011299: Ocular Disease Therapeutics: Design and Delivery of Drugs for Diseases of the Eye.

description: Small molecule binding data for protein Adenosine receptor A1, Adenosine receptor A3, Complement C5, Complement factor D, Nitric oxide synthase, inducible, Rho-associated protein kinase 1, and Rho-associated protein kinase 2, Uniprot O75116, P00746, P01031, P0DMS8, P29477, P30542, and Q13464
DOI: 10.7270/q2zk5m9j
title: BindingDB Entry 50011633: Design, synthesis, and biological evaluation of 2,6,7-substituted pyrrolo[2,3-d]pyrimidines as cyclin dependent kinase inhibitor in pancreatic cancer cells.

description: Small molecule binding data for protein Cyclin-dependent kinase 4/G1/S-specific cyclin-D1 and Cyclin-dependent kinase 6/G1/S-specific cyclin-D1, Uniprot P11802, P24385, and Q00534
DOI: 10.7270/q2zk5mb0
title: BindingDB Entry 50012259: An orally available inverse agonist of estrogen-related receptor gamma showed expanded efficacy for the radioiodine therapy of poorly differentiated thyroid cancer.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Estrogen receptor, Estrogen-related receptor gamma, Steroid hormone receptor ERR1, and Steroid hormone receptor ERR2, Uniprot O95718, P03372, P11474, P40989, and P62508
DOI: 10.7270/q2zk5mcf
title: BindingDB Entry 50012887: Synthesis and evaluation of 17α-triazolyl and 9α-cyano derivatives of estradiol.

description: Small molecule binding data for protein Estrogen receptor and Estrogen receptor beta, Uniprot P03372 and Q92731
DOI: 10.7270/q2zk5mdw
title: BindingDB Entry 50013529: Privileged scaffolds in medicinal chemistry: Studies on pyrazolo[1,5-a]pyrimidines on sulfonamide containing Carbonic Anhydrase inhibitors.

description: Small molecule binding data for protein Carbonic anhydrase 1, Carbonic anhydrase 12, Carbonic anhydrase 2, Carbonic anhydrase 5A, mitochondrial, and Carbonic anhydrase 9, Uniprot O43570, P00915, P00918, P35218, and Q16790
DOI: 10.7270/q2zk5mfb
title: BindingDB Entry 50014184: Modulation of KRAS Mutant by Inhibiting PLK1 Kinase in Cancer Therapeutics.

description: Small molecule binding data for protein Serine/threonine-protein kinase PLK1 and Wee1-like protein kinase, Uniprot P30291 and P53350
DOI: 10.7270/q2zk5mgs
title: BindingDB Entry 50014533: Feature-Based Molecular Networking for the Targeted Identification of G

description: Small molecule binding data for protein Guanine nucleotide-binding protein G(q) subunit alpha, Uniprot P50148
DOI: 10.7270/q2zp495p
title: BindingDB Entry 9379: 1H-pyrazolo[4,3-b]pyridines as PDE1 inhibitors

description: Small molecule binding data for protein Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A, Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B, and Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C, Uniprot P54750, Q01064, and Q14123
DOI: 10.7270/q2zp4964
title: BindingDB Entry 9766: Heteroaryl SYK inhibitors

description: Small molecule binding data for protein Aurora kinase B, Glycogen synthase kinase-3 beta, Receptor-type tyrosine-protein kinase FLT3, and Tyrosine-protein kinase SYK [342-635], Uniprot P36888, P43405, P49841, and Q96GD4
DOI: 10.7270/q2zp497k
title: BindingDB Entry 10153: Indazole derivatives useful as inhibitors of diacylglyceride O-acyltransferase 2

description: Small molecule binding data for protein Diacylglycerol O-acyltransferase 2, Uniprot Q96PD7
DOI: 10.7270/q2zp4981
title: BindingDB Entry 10362: PREPARATION OF BENZIMIDAZOLONE DERIVATIVES AS NOVEL DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 INHIBITORS

description: Small molecule binding data for protein Diacylglycerol O-acyltransferase 2, Uniprot Q96PD7
DOI: 10.7270/q2zp499g
title: BindingDB Entry 10540: SUBSTITUTED MORPHOLINE COMPOUNDS

description: Small molecule binding data for protein Phosphatidylinositol 3-kinase catalytic subunit type 3, Uniprot Q8NEB9
DOI: 10.7270/q2zp49bx
title: BindingDB Entry 10749: Heterocycle compounds as Tyro3, Axl and MerTK (TAM) family of receptor tyrosine kinase inhibitors

description: Small molecule binding data for protein Hepatocyte growth factor receptor, Tyrosine-protein kinase Mer, and Tyrosine-protein kinase receptor UFO, Uniprot P08581, P30530, and Q12866
DOI: 10.7270/q2zp49cc
title: BindingDB Entry 50006955: Nitro-Group-Containing Drugs.

description: Small molecule binding data for protein Epidermal growth factor receptor, Oxygen-insensitive NAD(P)H nitroreductase, and Quinone oxidoreductase, Uniprot P00533, P38489, and Q08257
DOI: 10.7270/q2zp49dt
title: BindingDB Entry 50007567: Novel benzothiazole hydrazine carboxamide hybrid scaffolds as potential in vitro GABA AT enzyme inhibitors: Synthesis, molecular docking and antiepileptic evaluation.

description: Small molecule binding data for protein 4-aminobutyrate aminotransferase, mitochondrial, Uniprot P61922
DOI: 10.7270/q2zp49f8
title: BindingDB Entry 50008166: Structure-activity relationship studies on Bax activator SMBA1 for the treatment of ER-positive and triple-negative breast cancer.

description: Small molecule binding data for protein Apoptosis regulator BAX, Uniprot Q07812
DOI: 10.7270/q2zp49gq
title: BindingDB Entry 50008488: Application of Fluorine- and Nitrogen-Walk Approaches: Defining the Structural and Functional Diversity of 2-Phenylindole Class of Cannabinoid 1 Receptor Positive Allosteric Modulators.

description: Small molecule binding data for protein Cannabinoid receptor 1, Uniprot P20272 and P21554
DOI: 10.7270/q2zp49h5
title: BindingDB Entry 50008818: Discovery of ABT-957: 1-Benzyl-5-oxopyrrolidine-2-carboxamides as selective calpain inhibitors with enhanced metabolic stability.

description: Small molecule binding data for protein Calpain-1 catalytic subunit, Uniprot P07384
DOI: 10.7270/q2zp49jm
title: BindingDB Entry 50009144: A rational search for discovering potential neutraligands of human complement fragment 5a (

description: Small molecule binding data for protein Complement C5, Uniprot P01031
DOI: 10.7270/q2zp49k2
title: BindingDB Entry 50009434: Neurobehavioral investigation and acetylcholinesterase inhibitory activity study for some new coumarin derivatives.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot P22303
DOI: 10.7270/q2zp49mh
title: BindingDB Entry 50009777: Fragment-based screening of programmed death ligand 1 (PD-L1).

description: Small molecule binding data for protein Programmed cell death 1 ligand 1, Uniprot Q9NZQ7
DOI: 10.7270/q2zp49nz
title: BindingDB Entry 50010353: Novel compounds that reverse the disease phenotype in Type 2 Gaucher disease patient-derived cells.

description: Small molecule binding data for protein Lysosomal acid glucosylceramidase, Uniprot P04062
DOI: 10.7270/q2zp49pd
title: BindingDB Entry 50010962: Sulfonamide-based 4-anilinoquinoline derivatives as novel dual Aurora kinase (AURKA/B) inhibitors: Synthesis, biological evaluation and in silico insights.

description: Small molecule binding data for protein Aurora kinase A and Aurora kinase B, Uniprot O14965 and Q96GD4
DOI: 10.7270/q2zp49qv
title: BindingDB Entry 50011596: The discovery of quinoline derivatives, as NF-κB inducing kinase (NIK) inhibitors with anti-inflammatory effects in vitro, low toxicities against T cell growth.

description: Small molecule binding data for protein Mitogen-activated protein kinase kinase kinase 14, Uniprot Q99558
DOI: 10.7270/q2zp49r9
title: BindingDB Entry 50011932: Synthesis, anticancer and antimicrobial evaluation of new benzofuran based derivatives: PI3K inhibition, quorum sensing and molecular modeling study.

description: Small molecule binding data for protein Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform, Uniprot P42336
DOI: 10.7270/q2zp49sr
title: BindingDB Entry 50012214: Pyridin-2(1H)one derivatives: A possible new class of therapeutics for mechanical allodynia.

description: Small molecule binding data for protein Mitogen-activated protein kinase 14, Uniprot Q16539
DOI: 10.7270/q2zp49t6
title: BindingDB Entry 50012556: Synthesis and biological evaluation of novel FK228 analogues as potential isoform selective HDAC inhibitors.

description: Small molecule binding data for protein Histone deacetylase 1 and Histone deacetylase 6, Uniprot Q13547 and Q9Z2V5
DOI: 10.7270/q2zp49vn
title: BindingDB Entry 50013194: Molecular modeling-guided optimization of acetylcholinesterase reactivators: A proof for reactivation of covalently inhibited targets.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot P22303
DOI: 10.7270/q2zp49w3
title: BindingDB Entry 50013823: Discovery of selective CDK9 degraders with enhancing antiproliferative activity through PROTAC conversion.

description: Small molecule binding data for protein Cyclin-T1/Cyclin-dependent kinase 9, Uniprot O60563 and P50750
DOI: 10.7270/q2zp49xj
title: BindingDB Entry 50014477: Transient Receptor Potential Ankyrin 1 (TRPA1) Antagonists May Provide a Superior Treatment for Pain and Migraine.

description: Small molecule binding data for protein Transient receptor potential cation channel subfamily A member 1, Uniprot O75762
DOI: 10.7270/q2zs30mf
title: BindingDB Entry 9170: Boronic acid derivatives

description: Small molecule binding data for protein Proteasome subunit beta type-5 and Proteasome subunit beta type-8, Uniprot P28062 and P28074
DOI: 10.7270/q2zs30nw
title: BindingDB Entry 9557: Imidazopyrazine inhibitors of Bruton's tyrosine kinase

description: Small molecule binding data for protein Cytoplasmic tyrosine-protein kinase BMX, Epidermal growth factor receptor, Receptor tyrosine-protein kinase erbB-2, Receptor tyrosine-protein kinase erbB-4, Tyrosine-protein kinase BTK, Tyrosine-protein kinase Blk, Tyrosine-protein kinase ITK/TSK, Tyrosine-protein kinase JAK3, Tyrosine-protein kinase TXK, and Tyrosine-protein kinase Tec, Uniprot P00533, P04626, P42680, P42681, P51451, P51813, P52333, Q06187, Q08881, and Q15303
DOI: 10.7270/q2zs30pb
title: BindingDB Entry 9944: Tricyclic heterocyclic derivatives and uses thereof

description: Small molecule binding data for protein Macrophage colony-stimulating factor 1 receptor and Vascular endothelial growth factor receptor 2, Uniprot P07333 and P35968
DOI: 10.7270/q2zs30qs
title: BindingDB Entry 10331: Alkyl substituted triazole compounds as agonists of the APJ Receptor

description: Small molecule binding data for protein Apelin receptor, Uniprot P35414
DOI: 10.7270/q2zs30r7
title: BindingDB Entry 10718: Substituted heterocyclic derivatives as PI3K inhibitors

description: Small molecule binding data for protein Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, Uniprot O00329 and P48736
DOI: 10.7270/q2zs30sp
title: BindingDB Entry 10927: Substituted piperidine compounds and their use

description: Small molecule binding data for protein Orexin receptor type 2 and Orexin/Hypocretin receptor type 1, Uniprot O43613 and O43614
DOI: 10.7270/q2zs30t4
title: BindingDB Entry 50006907: Discovery of a potent histone deacetylase (HDAC) 3/6 selective dual inhibitor.

description: Small molecule binding data for protein DNA (cytosine-5)-methyltransferase 1, DNA (cytosine-5)-methyltransferase 3A, Histone deacetylase 1/2/3, Histone deacetylase 11, Histone deacetylase 2, Histone deacetylase 3, Histone deacetylase 6, Histone deacetylase 8, Histone-lysine N-methyltransferase EHMT2, and Polyamine deacetylase HDAC10, Uniprot O15379, P26358, Q13547, Q92769, Q969S8, Q96DB2, Q96KQ7, Q9BY41, Q9UBN7, and Q9Y6K1
DOI: 10.7270/q2zs30vk
title: BindingDB Entry 50007218: Modification of the Thioglycosyl-Naphthalimides as Potent and Selective Human O-GlcNAcase Inhibitors.

description: Small molecule binding data for protein Beta-hexosaminidase subunit beta and Protein O-GlcNAcase, Uniprot O60502 and P07686