cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2dj5k7x
title: BindingDB Entry 50011369: TBA

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A, 5-hydroxytryptamine receptor 2A, 5-hydroxytryptamine receptor 6, 5-hydroxytryptamine receptor 7, D(2) dopamine receptor, Histamine H1 receptor, and Sodium-dependent serotonin transporter, Uniprot P08908, P14416, P28223, P31645, P34969, P35367, and P50406
DOI: 10.7270/q2dj5k8c
title: BindingDB Entry 50011650: Discovery of a Pyrimidothiazolodiazepinone as a Potent and Selective Focal Adhesion Kinase (FAK) Inhibitor.

description: Small molecule binding data for protein CDK-activating kinase assembly factor MAT1/Cyclin-H/Cyclin-dependent kinase 7, Cyclin-dependent kinase/G2/mitotic-specific cyclin- 1, Focal adhesion kinase 1, Glycogen synthase kinase-3 beta, Insulin-like growth factor 1 receptor, Protein-tyrosine kinase 2-beta, and Serine/threonine-protein kinase PLK1, Uniprot P06493, P08069, P14635, P49841, P50613, P51946, P51948, P53350, Q05397, and Q14289
DOI: 10.7270/q2dj5k9t
title: BindingDB Entry 50012009: On the intrinsic reactivity of highly potent trypanocidal cruzain inhibitors.

description: Small molecule binding data for protein Cruzipain, Uniprot P25779
DOI: 10.7270/q2dj5kcq
title: BindingDB Entry 50013257: Design, synthesis and biological activity of N

description: Small molecule binding data for protein Methionine synthase, Uniprot Q99707
DOI: 10.7270/q2dj5kd5
title: BindingDB Entry 50013903: An affinity prediction approach for the ligand of E3 ligase Cbl-b and an insight into substrate binding pattern.

description: Small molecule binding data for protein E3 ubiquitin-protein ligase CBL-B, Uniprot Q13191
DOI: 10.7270/q2dj5kfm
title: BindingDB Entry 50014259: Elucidation of Distinct Modular Assemblies of Smoothened Receptor by Bitopic Ligand Measurement.

description: Small molecule binding data for protein Smoothened homolog, Uniprot P56726
DOI: 10.7270/q2dj5kg2
title: BindingDB Entry 50014564: Discovery of LYC-55716: A Potent, Selective, and Orally Bioavailable Retinoic Acid Receptor-Related Orphan Receptor-γ (RORγ) Agonist for Use in Treating Cancer.

description: Small molecule binding data for protein Nuclear receptor ROR-alpha, Nuclear receptor ROR-beta, Nuclear receptor ROR-gamma, and Nuclear receptor subfamily 1 group I member 2, Uniprot O75469, P35398, P51449, and Q92753
DOI: 10.7270/q2dn4832
title: BindingDB Entry 9213: Amino-imidazopyridine derivatives as Janus kinase inhibitors and pharmaceutical use thereof

description: Small molecule binding data for protein Non-receptor tyrosine-protein kinase TYK2 [871-1187], Tyrosine-protein kinase JAK1 [850-1154], Tyrosine-protein kinase JAK2, and Tyrosine-protein kinase JAK3, Uniprot O60674, P23458, P29597, and P52333
DOI: 10.7270/q2dn484h
title: BindingDB Entry 9600: Heteroaromatic compounds as BTK inhibitors

description: Small molecule binding data for protein Tyrosine-protein kinase BTK, Uniprot Q06187
DOI: 10.7270/q2dn485z
title: BindingDB Entry 9987: 3-aryl- heteroaryl substituted 5-trifluoromethyl oxadiazoles as histonedeacetylase 6 (HDAC6) inhibitors

description: Small molecule binding data for protein Histone deacetylase 1, Histone deacetylase 5, Histone deacetylase 6, and Histone deacetylase 8, Uniprot Q13547, Q9BY41, Q9UBN7, and Q9UQL6
DOI: 10.7270/q2dn486d
title: BindingDB Entry 10196: Inhibitors of cyclin-dependent kinases

description: Small molecule binding data for protein Cyclin-dependent kinase 2, Cyclin-dependent kinase 7, and Cyclin-dependent kinase 9, Uniprot P24941, P50613, and P50750
DOI: 10.7270/q2dn487v
title: BindingDB Entry 10374: Substituted 6-(1H-pyrazol-1-yl)pyrimidin-4-amine derivatives and uses thereof

description: Small molecule binding data for protein Sodium-dependent phosphate transport protein 2A, Uniprot Q06495
DOI: 10.7270/q2dn4889
title: BindingDB Entry 10583: DIAMINOPYRIMIDINE CARBOXAMIDE INHIBITORS OF HPK1

description: Small molecule binding data for protein Mitogen-activated protein kinase kinase kinase kinase 1, Uniprot Q92918
DOI: 10.7270/q2dn489r
title: BindingDB Entry 50006699: Design, Synthesis, and Biological Evaluation of 2,4-Imidazolinedione Derivatives as HDAC6 Isoform-Selective Inhibitors.

description: Small molecule binding data for protein Histone deacetylase 1, Histone deacetylase 11, Histone deacetylase 2, Histone deacetylase 3, Histone deacetylase 4, Histone deacetylase 5, Histone deacetylase 6, Histone deacetylase 7, Histone deacetylase 8, Histone deacetylase 9, and Polyamine deacetylase HDAC10, Uniprot O15379, P56524, Q13547, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UKV0, and Q9UQL6
DOI: 10.7270/q2dn48b6
title: BindingDB Entry 50007291: Synthesis and biological evaluation of 3-aryl-4-indolyl-maleimides as potent mutant isocitrate dehydrogenase-1 inhibitors.

description: Small molecule binding data for protein Hexokinase-4, Isocitrate dehydrogenase [NADP] cytoplasmic, and Isocitrate dehydrogenase [NADP], mitochondrial, Uniprot O75874, P35557, and P48735
DOI: 10.7270/q2dn48cn
title: BindingDB Entry 50007908: Peptide derivatives as inhibitors of NS2B-NS3 protease from Dengue, West Nile, and Zika flaviviruses.

description: Small molecule binding data for protein Genome polyprotein and Nonstructural protein 3, Uniprot A0A024AXB9, P06935, and P29990
DOI: 10.7270/q2dn48d3
title: BindingDB Entry 50008509: Discovery of Selective Inhibitors of Endoplasmic Reticulum Aminopeptidase 1.

description: Small molecule binding data for protein Endoplasmic reticulum aminopeptidase 1, Endoplasmic reticulum aminopeptidase 2, and Interleukin-1 receptor antagonist protein, Uniprot P25085, Q6P179, and Q9NZ08
DOI: 10.7270/q2dn48fj
title: BindingDB Entry 50008886: Shooting three inflammatory targets with a single bullet: Novel multi-targeting anti-inflammatory glitazones.

description: Small molecule binding data for protein Prostaglandin G/H synthase 1 and Prostaglandin G/H synthase 2, Uniprot P05979 and P35354
DOI: 10.7270/q2dn48g0
title: BindingDB Entry 50009166: Benzothiazole-based compounds as potent endothelial lipase inhibitors.

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, Endothelial lipase, and Hepatic triacylglycerol lipase, Uniprot P05177, P08684, P10635, P11150, P11712, P33261, and Q9Y5X9
DOI: 10.7270/q2dn48hf
title: BindingDB Entry 50009510: Discovery of a Potent and Selective TRPC5 Inhibitor, Efficacious in a Focal Segmental Glomerulosclerosis Model.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Short transient receptor potential channel 4, Short transient receptor potential channel 5, Short transient receptor potential channel 6, Sodium channel protein type 5 subunit alpha, and Transient receptor potential protein 5, Uniprot P40989, Q14524, Q8VD38, Q9UBN4, Q9UL62, and Q9Y210
DOI: 10.7270/q2dn48jw
title: BindingDB Entry 50010116: Design, synthesis, and evaluation of isoflavone analogs as multifunctional agents for the treatment of Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase, Cholinesterase, and Histamine H3 receptor, Uniprot P21836, Q03311, and Q9Y5N1
DOI: 10.7270/q2dn48kb
title: BindingDB Entry 50010679: Luciferase-based HMG-CoA reductase degradation assay for activity and selectivity profiling of oxy(lano)sterols.

description: Small molecule binding data for protein 3-hydroxy-3-methylglutaryl-coenzyme A reductase, Uniprot P04035
DOI: 10.7270/q2dn48ms
title: BindingDB Entry 50011320: Thienochromene derivatives inhibit pSTAT1 and pSTAT5 signaling induced by cytokines.

description: Small molecule binding data for protein Non-receptor tyrosine-protein kinase TYK2/Tyrosine-protein kinase JAK1/Tyrosine-protein kinase JAK2/Tyrosine-protein kinase JAK3, Uniprot O60674, P23458, P29597, and P52333
DOI: 10.7270/q2dn48n7
title: BindingDB Entry 50011964: Discovery of Orally Active Isofuranones as Potent, Selective Inhibitors of Hematopoetic Progenitor Kinase 1.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2, Interleukin-1 receptor-associated kinase 4, Mitogen-activated protein kinase kinase kinase kinase 1, and Mitogen-activated protein kinase kinase kinase kinase 3, Uniprot P40989, Q8IVH8, Q92918, and Q9NWZ3
DOI: 10.7270/q2dn48pp
title: BindingDB Entry 50012276: Optimization of pyrazolo[1,5-a]pyrimidines lead to the identification of a highly selective casein kinase 2 inhibitor.

description: Small molecule binding data for protein Casein kinase II subunit alpha, Casein kinase II subunit alpha', Cyclin-dependent kinase/G2/mitotic-specific cyclin- 1, Death-associated protein kinase 3, Dual specificity protein kinase CLK3, Homeodomain-interacting protein kinase 3, Receptor-type tyrosine-protein kinase FLT3, Serine/threonine-protein kinase TBK1, and Serine/threonine-protein kinase pim-1, Uniprot O43293, P06493, P11309, P14635, P19784, P36888, P49761, P68400, Q9H422, and Q9UHD2
DOI: 10.7270/q2dn48q4
title: BindingDB Entry 50012571: Inhibition of Low Molecular Weight Protein Tyrosine Phosphatase by an Induced-Fit Mechanism.

description: Small molecule binding data for protein Dual specificity protein phosphatase 23, Dual specificity protein phosphatase 3, Dual specificity protein phosphatase 6, Dual specificity protein phosphatase CDC14A, Low molecular weight phosphotyrosine protein phosphatase, RNA polymerase II subunit A C-terminal domain phosphatase SSU72, Receptor-type tyrosine-protein phosphatase C, Receptor-type tyrosine-protein phosphatase F, Receptor-type tyrosine-protein phosphatase S, Receptor-type tyrosine-protein phosphatase alpha, Receptor-type tyrosine-protein phosphatase beta, Receptor-type tyrosine-protein phosphatase epsilon, Receptor-type tyrosine-protein phosphatase gamma, Receptor-type tyrosine-protein phosphatase mu, Type II inositol 1,4,5-trisphosphate 5-phosphatase, Tyrosine-protein phosphatase non-receptor type 1, Tyrosine-protein phosphatase non-receptor type 11, Tyrosine-protein phosphatase non-receptor type 12, Tyrosine-protein phosphatase non-receptor type 13, Tyrosine-protein phosphatase non-receptor type 2, Tyrosine-protein phosphatase non-receptor type 22, Tyrosine-protein phosphatase non-receptor type 6, Tyrosine-protein phosphatase non-receptor type 7, and Tyrosine-protein phosphatase non-receptor type 9, Uniprot P08575, P10586, P17706, P18031, P18433, P23467, P23469, P23470, P24666, P28827, P29350, P32019, P35236, P43378, P51452, Q05209, Q06124, Q12923, Q13332, Q16828, Q9BVJ7, Q9NP77, Q9UNH5, and Q9Y2R2
DOI: 10.7270/q2dn48rk
title: BindingDB Entry 50012908: Impact of Allosteric Modulation in Drug Discovery: Innovation in Emerging Chemical Modalities.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Nuclear receptor ROR-gamma, Uniprot P21554 and P51449
DOI: 10.7270/q2dn48s1
title: BindingDB Entry 50013548: Discovery of 1,3,4-oxadiazole derivatives as potential antitumor agents inhibiting the programmed cell death-1/programmed cell death-ligand 1 interaction.

description: Small molecule binding data for protein Programmed cell death 1 ligand/protein 1, Uniprot Q15116 and Q9NZQ7
DOI: 10.7270/q2dn48tg
title: BindingDB Entry 50014208: Discovery of 2,4-pyrimidinediamine derivatives as potent dual inhibitors of ALK and HDAC.

description: Small molecule binding data for protein ALK tyrosine kinase receptor, Histone deacetylase 1, Histone deacetylase 2, and Histone deacetylase 6, Uniprot Q13547, Q92769, Q9UBN7, and Q9UM73
DOI: 10.7270/q2dr2zjf
title: BindingDB Entry 9182: 1,2-substituted cyclopentanes as orexin receptor antagonists

description: Small molecule binding data for protein Orexin receptor type 2 and Orexin/Hypocretin receptor type 1, Uniprot O43613 and O43614
DOI: 10.7270/q2dr2zkw
title: BindingDB Entry 9391: Heterocyclic compounds for the inhibition of PASK

description: Small molecule binding data for protein PAS domain-containing serine/threonine-protein kinase, Uniprot Q96RG2
DOI: 10.7270/q2dr2zmb
title: BindingDB Entry 9778: Selective NR2B antagonists

description: Small molecule binding data for protein Glutamate receptor ionotropic, NMDA 2B, Uniprot Q00960
DOI: 10.7270/q2dr2zns
title: BindingDB Entry 10165: Sultam compound and application method thereof

description: Small molecule binding data for protein Isocitrate dehydrogenase [NADP] cytoplasmic [R132C] and Isocitrate dehydrogenase [NADP] cytoplasmic [R132H], Uniprot O75874
DOI: 10.7270/q2dr2zp7
title: BindingDB Entry 10552: Tosylacetate based compounds and derivatives thereof as PHGDH inhibitors

description: Small molecule binding data for protein D-3-phosphoglycerate dehydrogenase, Uniprot O43175
DOI: 10.7270/q2dr2zqp
title: BindingDB Entry 10761: Inhibitors of protein kinases

description: Small molecule binding data for protein Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, Tyrosine-protein kinase JAK3, and Tyrosine-protein kinase SYK, Uniprot O60674, P23458, P43405, and P52333
DOI: 10.7270/q2dr2zr4
title: BindingDB Entry 50004338: On the Process of Discovering Leads That Target the Heparin-Binding Site of Neutrophil Elastase in the Sputum of Cystic Fibrosis Patients.

description: Small molecule binding data for protein Cathepsin G, Myeloblastin, and Neutrophil elastase, Uniprot P08246, P08311, and P24158
DOI: 10.7270/q2dr2zsk
title: BindingDB Entry 50006975: Recent developments in the synthesis and applications of phosphinic peptide analogs.

description: Small molecule binding data for protein 72 kDa type IV collagenase, Aminopeptidase N, Collagenase 3, Cytosol aminopeptidase, Endoplasmic reticulum aminopeptidase 1, Endoplasmic reticulum aminopeptidase 2, Interleukin-1 receptor antagonist protein, Leukotriene A-4 hydrolase, M17 leucyl aminopeptidase, Macrophage metalloelastase, Matrix metalloproteinase-9, and Neutrophil collagenase, Uniprot P08253, P09960, P14780, P15145, P18510, P22894, P28839, P39900, P45452, Q6P179, Q8IL11, and Q9NZ08
DOI: 10.7270/q2dr2zt1
title: BindingDB Entry 50007238: Ligand design for somatostatin receptor isoforms 4 and 5.

description: Small molecule binding data for protein Somatostatin receptor type 4 and Somatostatin receptor type 5, Uniprot P31391 and P35346
DOI: 10.7270/q2dr2zvg
title: BindingDB Entry 50007585: Synthesis of oxadiazole-coupled-thiadiazole derivatives as a potent β-glucuronidase inhibitors and their molecular docking study.

description: Small molecule binding data for protein Beta-glucuronidase, Uniprot P08236
DOI: 10.7270/q2dr2zwx
title: BindingDB Entry 50008187: Light-controlled inhibition of BRAFV600E kinase.

description: Small molecule binding data for protein Serine/threonine-protein kinase B-raf, Uniprot P15056
DOI: 10.7270/q2dr2zxc
title: BindingDB Entry 50008842: Chemical modification-mediated optimisation of bronchodilatory activity of mepenzolate, a muscarinic receptor antagonist with anti-inflammatory activity.

description: Small molecule binding data for protein Muscarinic acetylcholine receptor M2 and Muscarinic acetylcholine receptor M3, Uniprot P08172 and P20309
DOI: 10.7270/q2dr2zzt
title: BindingDB Entry 50009452: Synthesis and antidepressant effect of novel aralkyl piperazine and piperidine derivatives targeting SSRI/5-HT

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A, 5-hydroxytryptamine receptor 7, and Sodium-dependent serotonin transporter, Uniprot P08908, P31652, and P34969
DOI: 10.7270/q2dr3002
title: BindingDB Entry 50009797: Jatrophane Diterpenoids from Euphorbia glomerulans.

description: Small molecule binding data for protein ATP-dependent translocase ABCB1, Uniprot P08183
DOI: 10.7270/q2dr301h
title: BindingDB Entry 50010070: Discovery and synthetic optimization of a novel scaffold for hydrophobic tunnel-targeted autotaxin inhibition.

description: Small molecule binding data for protein Ectonucleotide pyrophosphatase/phosphodiesterase family member 2, Uniprot Q13822
DOI: 10.7270/q2dr302z
title: BindingDB Entry 50010367: Insights into Protein-Ligand Interactions in Integrin Complexes: Advances in Structure Determinations.

description: Small molecule binding data for protein Integrin alpha-2/beta-1, Integrin alpha-4/beta-1, Integrin alpha-IIb/beta-3, Integrin alpha-L/beta-2, Integrin alpha-V/beta-1, and Integrin alpha-V/beta-3, Uniprot P05106, P05107, P05556, P06756, P08514, P13612, P17301, and P20701
DOI: 10.7270/q2dr303d
title: BindingDB Entry 50010983: Enzymatic biosynthesis and biological evaluation of novel 17-AAG glucoside as potential anti-cancer agents.

description: Small molecule binding data for protein Heat shock protein HSP 90-alpha/90-beta, Uniprot P07900 and P08238
DOI: 10.7270/q2dr304v
title: BindingDB Entry 50011609: Design and development of FGF-23 antagonists: Definition of the pharmacophore and initial structure-activity relationships probed by synthetic analogues.

description: Small molecule binding data for protein Fibroblast growth factor 23, Uniprot Q9GZV9
DOI: 10.7270/q2dr3059
title: BindingDB Entry 50012233: A novel pipeline of 2-(benzenesulfonamide)-N-(4-hydroxyphenyl) acetamide analgesics that lack hepatotoxicity and retain antipyresis.

description: Small molecule binding data for protein Cytochrome P450 2D6 and Cytochrome P450 3A4, Uniprot P08684 and P10635
DOI: 10.7270/q2dr306r
title: BindingDB Entry 50012847: Discovery of

description: Small molecule binding data for protein ATP-dependent 6-phosphofructokinase, liver type, Adenosine kinase, Fructose-1,6-bisphosphatase 1, and Glycogen phosphorylase, liver form, Uniprot P09467, P30835, P55263, and Q9ET01
DOI: 10.7270/q2dr3076
title: BindingDB Entry 50013207: Pyxinol bearing amino acid residues: Easily achievable and promising modulators of P-glycoprotein-mediated multidrug resistance.

description: Small molecule binding data for protein ATP-binding cassette sub-family C member 2 and Broad substrate specificity ATP-binding cassette transporter ABCG2, Uniprot Q92887 and Q9UNQ0
DOI: 10.7270/q2dr308n
title: BindingDB Entry 50013498: Novel triazole-sulfonamide bearing pyrimidine moieties with carbonic anhydrase inhibitory action: Design, synthesis, computational and enzyme inhibition studies.

description: Small molecule binding data for protein Carbonic anhydrase 1, Carbonic anhydrase 12, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot O43570, P00915, P00918, and Q16790
DOI: 10.7270/q2dr3093
title: BindingDB Entry 50013845: Variously substituted 2-oxopyridine derivatives: Extending the structure-activity relationships for allosteric modulation of the cannabinoid CB2 receptor.

description: Small molecule binding data for protein Cannabinoid receptor 2, Uniprot P34972
DOI: 10.7270/q2dr30bj
title: BindingDB Entry 50014498: A novel Hsp70 inhibitor specifically targeting the cancer-related Hsp70-Bim protein-protein interaction.

description: Small molecule binding data for protein Apoptosis regulator Bcl-2, Uniprot P10415
DOI: 10.7270/q2dv1nx9
title: BindingDB Entry 9360: HIV protease inhibitors

description: Small molecule binding data for protein Envelope glycoprotein gp160, Uniprot P04578
DOI: 10.7270/q2dv1nzr
title: BindingDB Entry 9569: Methods of treatment using pyrrolidinyl urea, thiourea, guanidine and cyanoguanidine compounds

description: Small molecule binding data for protein High affinity nerve growth factor receptor, Uniprot P04629
DOI: 10.7270/q2dv1p0m
title: BindingDB Entry 9747: Heterocyclic compounds and uses thereof

description: Small molecule binding data for protein Phosphatidylinositol 3-kinase regulatory subunit beta, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, Uniprot O00329, O00459, P42336, and P48736
DOI: 10.7270/q2dv1p12
title: BindingDB Entry 9956: Compounds of formulas (VII), (VIII), (IX), (XI), (XII), (XIII), and (XIV) as muscarinic receptor 4(M4) antagonists for treating neurological diseases

description: Small molecule binding data for protein Muscarinic acetylcholine receptor M1, Muscarinic acetylcholine receptor M2, Muscarinic acetylcholine receptor M3, Muscarinic acetylcholine receptor M4, and Muscarinic acetylcholine receptor M5, Uniprot P08172, P08173, P08912, P11229, and P20309
DOI: 10.7270/q2dv1p2h
title: BindingDB Entry 10343: Rho kinase inhibitor BA-1049 (R) and active metabolites thereof

description: Small molecule binding data for protein Rho-associated protein kinase 1 and Rho-associated protein kinase 2, Uniprot O75116 and Q13464
DOI: 10.7270/q2dv1p3z
title: BindingDB Entry 10730: [1,2,4]Triazolo derivatives as PDE1 inhibitors for the treatment of diabetes

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, Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C, Rod cGMP-specific 3',5'-cyclic phosphodiesterase subunit alpha/beta, cAMP-specific 3',5'-cyclic phosphodiesterase 4D, and cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A, Uniprot P16499, P35913, P54750, Q01064, Q08499, Q14123, and Q14432
DOI: 10.7270/q2dv1p4d
title: BindingDB Entry 50006921: Design, synthesis, and evaluation of compounds capable of reducing Pseudomonas aeruginosa virulence.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GSC2 and Transcriptional activator protein LasR, Uniprot P25084 and P40989
DOI: 10.7270/q2dv1p5v
title: BindingDB Entry 50007538: Design and synthesis of a novel 1H-pyrrolo[3,2-b]pyridine-3-carboxamide derivative as an orally available ACC1 inhibitor.

description: Small molecule binding data for protein Acetyl-CoA carboxylase 1 and Acetyl-CoA carboxylase 2, Uniprot O00763 and Q13085
DOI: 10.7270/q2dv1p69
title: BindingDB Entry 50007853: Dipropargyl substituted diphenylpyrimidines as dual inhibitors of monoamine oxidase and acetylcholinesterase.

description: Small molecule binding data for protein Acetylcholinesterase, Amine oxidase [flavin-containing] A, and Amine oxidase [flavin-containing] B, Uniprot O42275, P21397, and P27338
DOI: 10.7270/q2dv1p7r
title: BindingDB Entry 50008141: Discovery and optimization of a series of small-molecule allosteric inhibitors of MALT1 protease.

description: Small molecule binding data for protein Mucosa-associated lymphoid tissue lymphoma translocation protein 1, Uniprot Q9UDY8
DOI: 10.7270/q2dv1p86
title: BindingDB Entry 50008463: Naturally Occurring Lumazines.

description: Small molecule binding data for protein Cathepsin B and Sortase family protein, Uniprot P07858 and Q9S446
DOI: 10.7270/q2dv1p9n
title: BindingDB Entry 50009112: DL5050, a Selective Agonist for the Human Constitutive Androstane Receptor.

description: Small molecule binding data for protein Nuclear receptor subfamily 1 group I member 2 and Nuclear receptor subfamily 1 group I member 3, Uniprot O75469 and Q14994
DOI: 10.7270/q2dv1pb3
title: BindingDB Entry 50009744: Antiproliferative and Antimigratory Effects of a Novel YAP-TEAD Interaction Inhibitor Identified Using in Silico Molecular Docking.

description: Small molecule binding data for protein Transcriptional enhancer factor TEF-1, Transcriptional enhancer factor TEF-3, Transcriptional enhancer factor TEF-4, and Transcriptional enhancer factor TEF-5, Uniprot P28347, Q15561, Q15562, and Q99594
DOI: 10.7270/q2dv1pcj
title: BindingDB Entry 50010328: Design, synthesis and activity evaluation of indole-based double - Branched HDAC1 inhibitors.

description: Small molecule binding data for protein Histone deacetylase 1/2/3/4/5/6/7/8/9/11/Polyamine deacetylase HDAC10, Histone deacetylase 11, Histone deacetylase 6, and Histone deacetylase 8, Uniprot O15379, P56524, Q13547, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UKV0, and Q9UQL6
DOI: 10.7270/q2dv1pd0
title: BindingDB Entry 50010628: GPBAR1 Activation by C6-Substituted Hyodeoxycholane Analogues Protect against Colitis.

description: Small molecule binding data for protein G-protein coupled bile acid receptor 1, Uniprot Q8TDU6