cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2xk8dcs
title: BindingDB Entry 7406: PDE 10a inhibitors for the treatment of type II diabetes

description: Small molecule binding data for protein Phosphodiesterase 10A (PDE10A2) and Phosphodiesterase Type 10 (PDE10A), Uniprot Q9QYJ6
DOI: 10.7270/q2000101
title: BindingDB Entry 8087: Potent inhibitory effects of benzyl and p-xylidine-bis dithiocarbamate sodium salts on activities of mushroom tyrosinase.

description: Small molecule binding data for protein Tyrosinase, Uniprot Q00024
DOI: 10.7270/q21c1vpd
title: BindingDB Entry 7413: Synthesis and in vitro acetylcholinesterase and butyrylcholinesterase inhibitory potential of hydrazide based Schiff bases.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot P04058 and P06276
DOI: 10.7270/q23b5xwq
title: BindingDB Entry 6799: Mechanistic studies of inactivation of inducible nitric oxide synthase by amidines.

description: Small molecule binding data for protein Nitric Oxide Synthase, inducible, Uniprot P29477
DOI: 10.7270/q23r0rr3
title: BindingDB Entry 8086: Synthesis and activity of amides of tripeptides as potential urokinase inhibitors.

description: Small molecule binding data for protein Plasminogen, Prothrombin, Trypsin-1, and Urokinase-type plasminogen activator, Uniprot P00734, P00747, P00749, and P07477
DOI: 10.7270/q2542mcp
title: BindingDB Entry 7412: Synthesis of novel disulfide and sulfone hybrid scaffolds as potent β-glucuronidase inhibitor.

description: Small molecule binding data for protein Beta-glucuronidase (β-glucuronidase)
DOI: 10.7270/q2736pnw
title: BindingDB Entry 6798: Detecting a quasi-stable imine species on the reaction pathway of SHV-1 β-lactamase and 6β-(hydroxymethyl)penicillanic acid sulfone.

description: Small molecule binding data for protein SHV-1 beta-lactamase, Uniprot P0AD64
DOI: 10.7270/q27h1hgt
title: BindingDB Entry 8085: New antihyperglycemic, alpha-glucosidase inhibitory, and cytotoxic derivatives of benzimidazoles.

description: Small molecule binding data for protein alpha-Glucosidase (α-Glucosidase), Uniprot P23739
DOI: 10.7270/q28s4nr8
title: BindingDB Entry 7411: Selective glycosidase inhibitors and uses thereof

description: Small molecule binding data for protein N-acetyl-beta-D-glucosaminidase (O-GlcNAcase), Uniprot O60502
DOI: 10.7270/q2bv7fc9
title: BindingDB Entry 6797: Quinone reductase 2 is an adventitious target of protein kinase CK2 inhibitors TBBz (TBI) and DMAT.

description: Small molecule binding data for protein Ribosyldihydronicotinamide dehydrogenase [quinone], Uniprot P16083
DOI: 10.7270/q2c8286j
title: BindingDB Entry 8084: Stereoselective inhibition of butyrylcholinesterase by enantiomers of exo- and endo-2-norbornyl-N-n-butylcarbamates.

description: Small molecule binding data for protein Butyrylcholinesterase (BChE), Uniprot Q9N1N9
DOI: 10.7270/q2dj5dfj
title: BindingDB Entry 7410: Biaryl-propionic acid derivatives and their use as pharmaceuticals

description: Small molecule binding data for protein Cathepsin A
DOI: 10.7270/q2g15zq6
title: BindingDB Entry 8091: Synthesis and biological activity of progesterone derivatives as 5alpha-reductase inhibitors, and their effect on hamster prostate weight.

description: Small molecule binding data for protein 5-alpha-Reductase (5α-Reductase)
DOI: 10.7270/q2h130xv
title: BindingDB Entry 8083: Inactivation of acetylcholinesterase by various fluorophores.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot O42275 and P21836
DOI: 10.7270/q2j96558
title: BindingDB Entry 7409: N2,N4-bis(4-(piperazine-1-yl)phenyl)pirimidine-2,4-diamine derivative or pharmaceutically acceptable salt thereof, and composition containing same as active ingredient for preventing or treating cancer

description: Small molecule binding data for protein ALK tyrosine kinase receptor and ALK tyrosine kinase receptor (L1196M), Uniprot Q9UM73
DOI: 10.7270/q2kd1wnp
title: BindingDB Entry 6803: Identification and Co-complex Structure of a New S. pyogenes SpeB Small Molecule Inhibitor.

description: Small molecule binding data for protein Cysteine protease SpeB (SpeB) and Papain, Uniprot P00784 and P0C0J0
DOI: 10.7270/q2ks6qfm
title: BindingDB Entry 8090: Inhibitory effects of thioethers on fatty acid synthase and 3T3-L1 cells.

description: Small molecule binding data for protein Fatty acid synthase, Uniprot P12276
DOI: 10.7270/q2p26wxn
title: BindingDB Entry 7408: Guanidinobenzoic acid compound

description: Small molecule binding data for protein Trypsin and Trypsin-1, Uniprot P07477
DOI: 10.7270/q2qj7g6s
title: BindingDB Entry 8089: Synthesis and biological evaluation of biguanide and dihydrotriazine derivatives as potential inhibitors of dihydrofolate reductase of opportunistic microorganisms.

description: Small molecule binding data for protein Dihydrofolate Reductase (DHFR), Dihydrofolate reductase, and Dihydrofolate reductase (DHFR), Uniprot P16184, Q07422, and Q920D2
DOI: 10.7270/q2r2103v
title: BindingDB Entry 6793: Synthesis, biological evaluation, and docking studies of novel thiourea derivatives of bisindolylmethane as carbonic anhydrase II inhibitor.

description: Small molecule binding data for protein Carbonic anhydrase, Uniprot P00921
DOI: 10.7270/q2tt4pp3
title: BindingDB Entry 6801: Biochemical and structural analysis of an Eis family aminoglycoside acetyltransferase from bacillus anthracis.

description: Small molecule binding data for protein Eis_Ban acetyltransferase (Eis_Ban), Uniprot Q81P65
DOI: 10.7270/q2v986x3
title: BindingDB Entry 8088: Conferin, potent antioxidant and anti-inflammatory isoflavone from Caragana conferta Benth.

description: Small molecule binding data for protein Lipoxygenase-1, Uniprot P08170
DOI: 10.7270/q2zk5fdt
title: BindingDB Entry 6800: Inactivation of Mandelate Racemase by 3-Hydroxypyruvate Reveals a Potential Mechanistic Link between Enzyme Superfamilies.

description: Small molecule binding data for protein Mandelate racemase (MR), Uniprot P11444
DOI: 10.7270/q20c4tkg
title: BindingDB Entry 7421: A simple and efficient synthesis of novel inhibitors of alpha-glucosidase based on benzimidazole skeleton and molecular docking studies.

description: Small molecule binding data for protein alpha-Glucosidase (α-glucosidase), Uniprot P53008
DOI: 10.7270/q22b8wrb
title: BindingDB Entry 6807: Discovery of novel 17-phenylethylaminegeldanamycin derivatives as potent Hsp90 inhibitors.

description: Small molecule binding data for protein Heat-shock protein 90 (Hsp90), Uniprot Q58FG1
DOI: 10.7270/q22r3qjt
title: BindingDB Entry 8094: 3D-QSAR, molecular docking studies, and binding mode prediction of thiolactomycin analogs as mtFabH inhibitors.

description: Small molecule binding data for protein β-Ketoacyl-acyl carrier protein (ACP) synthase III (FabH), Uniprot P9WNG3
DOI: 10.7270/q2445k96
title: BindingDB Entry 7420: Coumarin-thiazole and -oxadiazole derivatives: Synthesis, bioactivity and docking studies for aldose/aldehyde reductase inhibitors.

description: Small molecule binding data for protein Aldehyde reductase (ALR1) and Aldose reductase (ALR2), Uniprot P16116 and Q3ZCJ2
DOI: 10.7270/q2639ng2
title: BindingDB Entry 6806: Identification of 1, 4-Dihydrothieno [3', 2':5, 6]thiopyrano[4, 3-c] pyrazole derivatives as human 5-Lipo-oxygenase inhibitors.

description: Small molecule binding data for protein 5-lipoxygenase/FLAP, Uniprot P09917
DOI: 10.7270/q26h4g8j
title: BindingDB Entry 8093: 3-arylidene-5-(4-isobutylphenyl)-2(3H)-furanones: a new series of anti-inflammatory and analgesic compounds having antimicrobial activity.

description: Small molecule binding data for protein Prostaglandin G/H synthase (Cyclooxygenase-2) and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P79208
DOI: 10.7270/q27w6b05
title: BindingDB Entry 7419: Design, synthesis and biological evaluation of coumarin derivatives as novel acetylcholinesterase inhibitors that attenuate H2O2-induced apoptosis in SH-SY5Y cells.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot P06276 and P22303
DOI: 10.7270/q29885wx
title: BindingDB Entry 8100: Characterisation of hydrazides and hydrazine derivatives as novel aspartic protease inhibitors.

description: Small molecule binding data for protein Cathepsin D and Plasmepsin 2, Uniprot P07339 and P46925
DOI: 10.7270/q29w0d7g
title: BindingDB Entry 6805: Kinetic and Structural Characterization of the Interaction of 6-Methylidene Penem 2 with the β-Lactamase from Mycobacterium tuberculosis.

description: Small molecule binding data for protein Class A beta-lactamase BlaC (BlaC), Uniprot P9WKD2
DOI: 10.7270/q2b85708
title: BindingDB Entry 8092: New insights into homopiperazine-based 5-HT1A/5-HT7R ligands: synthesis and biological evaluation.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 7 (5-HT7) and Serotonin (5-HT) receptor, Uniprot P19327 and P34969
DOI: 10.7270/q2cj8c95
title: BindingDB Entry 7418: Synthesis of novel bisindolylmethanes: New carbonic anhydrase II inhibitors, docking, and 3D pharmacophore studies.

description: Small molecule binding data for protein Carbonic anhydrase, Uniprot P00921
DOI: 10.7270/q2f18xm8
title: BindingDB Entry 8099: Inhibition studies of soybean (Glycine max) urease with heavy metals, sodium salts of mineral acids, boric acid, and boronic acids.

description: Small molecule binding data for protein Urease, Uniprot Q949H4
DOI: 10.7270/q2fn14zs
title: BindingDB Entry 6804: Design, Synthesis, and Evaluation of Polyamine Deacetylase Inhibitors, and High-Resolution Crystal Structures of Their Complexes with Acetylpolyamine Amidohydrolase.

description: Small molecule binding data for protein Acetylpolyamine amidohydrolase (APAH) and Histone deacetylase 8, Uniprot Q48935 and Q9BY41
DOI: 10.7270/q2h9940f
title: BindingDB Entry 7417: In silico binding analysis and SAR elucidations of newly designed benzopyrazine analogs as potent inhibitors of thymidine phosphorylase.

description: Small molecule binding data for protein Thymidine phosphorylase (TP)
DOI: 10.7270/q2jd4vjr
title: BindingDB Entry 6811: Synthesis and evaluation of salicylanilide derivatives as potential epidermal growth factor receptor inhibitors.

description: Small molecule binding data for protein EGFR
DOI: 10.7270/q2js9pbp
title: BindingDB Entry 8098: Semisynthesis of alpha-methyl-gamma-lactones and in vitro evaluation of their activity on protein farnesyltransferase.

description: Small molecule binding data for protein Protein farnesyltransferase (PFTase), Uniprot P01120
DOI: 10.7270/q2n29vqc
title: BindingDB Entry 7416: The synthesis of novel pyrazole-3,4-dicarboxamides bearing 5-amino-1,3,4-thiadiazole-2-sulfonamide moiety with effective inhibitory activity against the isoforms of human cytosolic carbonic anhydrase I and II.

description: Small molecule binding data for protein Carbonic anhydrase and Carbonic anhydrase 2, Uniprot P00915 and P00918
DOI: 10.7270/q2p55m71
title: BindingDB Entry 6810: 2-(Hetero(aryl)methylene)hydrazine-1-carbothioamides as potent urease inhibitors.

description: Small molecule binding data for protein Urease
DOI: 10.7270/q2pk0f2z
title: BindingDB Entry 8097: Nostotrebin 6, a bis(cyclopentenedione) with cholinesterase inhibitory activity isolated from Nostoc sp. str. Lukesová 27/97.

description: Small molecule binding data for protein Acetylcholinesterase and Butyrylcholinesterase (BChE), Uniprot O42275 and Q9N1N9
DOI: 10.7270/q2q23z0j
title: BindingDB Entry 6802: Inhibitor Bound Crystal Structures of Bacterial Nitric Oxide Synthase.

description: Small molecule binding data for protein Nitric oxide synthase (bsNOS), Uniprot O34453
DOI: 10.7270/q2qv3k9z
title: BindingDB Entry 7423: Haematopoietic-prostaglandin D2 synthase inhibitors

description: Small molecule binding data for protein Prostaglandin D Synthase, Uniprot O60760
DOI: 10.7270/q2rv0mgs
title: BindingDB Entry 7415: Synthesis, β-glucuronidase inhibition and molecular docking studies of hybrid bisindole-thiosemicarbazides analogs.

description: Small molecule binding data for protein beta-Glucuronidase (β-glucuronidase), Uniprot P08236
DOI: 10.7270/q2st7nk5
title: BindingDB Entry 6809: Synthesis and evaluation of a new series of 3,5-bis((5-bromo-6-methyl-2-t-aminopyrimidin-4-yl)thio)-4H-1,2,4-triazol-4-amines and their cyclized products 'pyrimidinylthio pyrimidotriazolothiadiazines' as 15- lipo-oxygenase inhibitors.

description: Small molecule binding data for protein Lipoxygenase-1, Uniprot P08170
DOI: 10.7270/q2tb15tq
title: BindingDB Entry 8096: Urease inhibitors from Hypericum oblongifolium WALL.

description: Small molecule binding data for protein Urease, Uniprot P07374
DOI: 10.7270/q2wm1c6h
title: BindingDB Entry 7414: Synthesis of pyrimidin-4-one-1,2,3-triazole conjugates as glycogen synthase kinase-3β inhibitors with anti-depressant activity.

description: Small molecule binding data for protein Glycogen synthase kinase-3, Uniprot P49841
DOI: 10.7270/q2xk8d8f
title: BindingDB Entry 6808: Structural basis for low-affinity binding of non-R2 carboxylate-substituted tricyclic quinoline analogs to CK2α: comparative molecular dynamics simulation studies.

description: Small molecule binding data for protein Protein Kinase CK2 (CK2α)
DOI: 10.7270/q2z31xj2
title: BindingDB Entry 8095: Quinazoline-urea, new protein kinase inhibitors in treatment of prostate cancer.

description: Small molecule binding data for protein Epidermal growth factor receptor and Vascular endothelial growth factor receptor 2, Uniprot P00533 and P35968
DOI: 10.7270/q21c1vk2
title: BindingDB Entry 6815: 1,2-Diaryl-2-hydroxyiminoethanones as dual COX-1 and β-amyloid aggregation inhibitors: biological evaluation and in silico study.

description: Small molecule binding data for protein Cyclooxygenase and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P35354
DOI: 10.7270/q21v5cv6
title: BindingDB Entry 8102: Effects of some drugs on human erythrocyte 6-phosphogluconate dehydrogenase: an in vitro study.

description: Small molecule binding data for protein 6-phosphogluconate dehydrogenase (6PGD), Uniprot P52209
DOI: 10.7270/q24m93d3
title: BindingDB Entry 8110: Effects of some drugs on human erythrocyte glucose 6-phosphate dehydrogenase: an in vitro study.

description: Small molecule binding data for protein Glucose 6-phosphate dehydrogenase (G6PD), Uniprot P11413
DOI: 10.7270/q2542m9s
title: BindingDB Entry 6814: Design, synthesis, biological screening, and molecular docking studies of piperazine-derived constrained inhibitors of DPP-IV for the treatment of type 2 diabetes.

description: Small molecule binding data for protein Dipeptidyl peptidase 4 (DPP4), Uniprot P27487
DOI: 10.7270/q25h7f5m
title: BindingDB Entry 8101: Design, synthesis, and urease inhibition studies of some 1,3,4-oxadiazoles and 1,2,4-triazoles derived from mandelic acid.

description: Small molecule binding data for protein Urease, Uniprot P07374
DOI: 10.7270/q26w98x8
title: BindingDB Entry 7427: Protease inhibitors

description: Small molecule binding data for protein Cathepsin K, Cathepsin L1, and Cathepsin S, Uniprot P07711, P25774, and P43235
DOI: 10.7270/q28914r3
title: BindingDB Entry 8108: 5-Nitro-2,6-dioxohexahydro-4-pyrimidinecarboxamides: synthesis, in vitro antimycobacterial activity, cytotoxicity, and isocitrate lyase inhibition studies.

description: Small molecule binding data for protein Isocitrate lyase (ICL), Uniprot P9WKK7
DOI: 10.7270/q28w3c16
title: BindingDB Entry 6813: Synthesis, biological evaluation, and molecular docking studies of xanthone sulfonamides as ACAT inhibitors.

description: Small molecule binding data for protein Acyl-CoA: cholesterol acyltransferase (ACAT), Uniprot P23141
DOI: 10.7270/q2bp01m3
title: BindingDB Entry 7426: Triazolyl PDE10 inhibitors

description: Small molecule binding data for protein Phosphodiesterase 10A (PDE10A2)
DOI: 10.7270/q2cn72nk
title: BindingDB Entry 6820: Modulators of calcium release-activated calcium channel and methods for treatment of non-small cell lung cancer

description: Small molecule binding data for protein Calcium release-activated calcium channel, Uniprot Q96D31
DOI: 10.7270/q2dn43sz
title: BindingDB Entry 6812: Synthesis and evaluation of antidepressant-like activity of some 4-substituted 1-(2-methoxyphenyl)piperazine derivatives.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 6 (5-HT6), 5-Hydroxytryptamine receptor 7 (5-HT7), and 5-hydroxytryptamine receptor 1A, Uniprot P08908, P34969, and P50406
DOI: 10.7270/q2gf0s90
title: BindingDB Entry 7425: Purinone derivative hydrochloride

description: Small molecule binding data for protein Fyn/BTK, LCK/BTK, and LynA/BTK, Uniprot P06239, P06241, P07948, and Q06187
DOI: 10.7270/q2hd7tdc
title: BindingDB Entry 6819: 4-(azacycloalkyl)benzene-1,3-diol compounds as tyrosinase inhibitors, process for the preparation thereof and use thereof in human medicine and in cosmetics

description: Small molecule binding data for protein Tyrosinase, Uniprot P07147
DOI: 10.7270/q2ht2n6v
title: BindingDB Entry 8106: Synthesis of new 8(S)-HETE analogs and their biological evaluation as activators of the PPAR nuclear receptors.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Uniprot P37231
DOI: 10.7270/q2m32tkj
title: BindingDB Entry 7424: Compounds and compositions as C-kit kinase inhibitors

description: Small molecule binding data for protein Tyrosine-protein kinase Kit (Kit), Uniprot P10721
DOI: 10.7270/q2nk3cx5
title: BindingDB Entry 8105: Tyrosinase inhibitory effect of benzoic acid derivatives and their structure-activity relationships.

description: Small molecule binding data for protein Tyrosinase, Uniprot Q00024
DOI: 10.7270/q2rx99tn
title: BindingDB Entry 6817: [1,3,4] oxadiazole derivative and application thereof

description: Small molecule binding data for protein Serotonin (5-HT) receptor, Uniprot P14842 and P19327
DOI: 10.7270/q2sb44nw
title: BindingDB Entry 8104: Carbocyclic potential DNA minor groove binders and their biological evaluation.

description: Small molecule binding data for protein Plasminogen, Trypsin-1, and Urokinase-type plasminogen activator, Uniprot P00747, P00749, and P07477
DOI: 10.7270/q2tm78xb
title: BindingDB Entry 7430: 6-oxopurine phosphoribosyltransferase inhibitors

description: Small molecule binding data for protein Hypoxanthine-guanine phosphoribosyltransferase (HGPRT), Hypoxanthine-guanine-xanthine phosphoribosyltransferase (PfHGXPRT), and Xanthine phosphoribosyltransferase (XGPRT), Uniprot A0A0J9TE27, P00492, P0A9M5, and P20035
DOI: 10.7270/q2vm4b24
title: BindingDB Entry 7422: Design, synthesis and biological evaluation of dihydroquinoxalinone derivatives as BRD4 inhibitors.

description: Small molecule binding data for protein Bromodomain protein 4 (BRD4-BD1)
DOI: 10.7270/q2wm1c4m
title: BindingDB Entry 6816: Morpholinyl derivatives useful as MOGAT-2 inhibitors

description: Small molecule binding data for protein Acyl-CoA:monoacylglycerol acyltransferase 2 (MOGAT2), Uniprot Q3SYC2
DOI: 10.7270/q2x34wc7
title: BindingDB Entry 8103: Design, synthesis and anticholinesterase activity of some new α-aminobisphosphonates.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot P22303
DOI: 10.7270/q2zc81ph
title: BindingDB Entry 7429: Substituted 6, 7-dialkoxy-3-isoquinoline derivatives as inhibitors of phosphodiesterase 10 (PDE 10A)

description: Small molecule binding data for protein Isoform 3 of cAMP-specific 3',5'-cyclic phosphodiesterase 4D and cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, Uniprot Q9Y233
DOI: 10.7270/q20c4thk
title: BindingDB Entry 6823: Method of treating contrast-induced nephropathy

description: Small molecule binding data for protein Neutral endopeptidase (NEP), Uniprot Q495T6
DOI: 10.7270/q20v8bpc
title: BindingDB Entry 8111: Pyrrolidine compounds

description: Small molecule binding data for protein Neurokinin 3 receptor, Uniprot P29371
DOI: 10.7270/q2251h0j
title: BindingDB Entry 7436: Triazole compounds that modulate Hsp90 activity

description: Small molecule binding data for protein Heat Shock Protein 90 (Hsp90), Uniprot P07900 and P08238
DOI: 10.7270/q2348j68
title: BindingDB Entry 7428: Substituted imidazopyrazines

description: Small molecule binding data for protein Dual specificity protein kinase TTK, Uniprot P33981
DOI: 10.7270/q23n229q
title: BindingDB Entry 8118: Disubstituted beta-lactones as inhibitors of N-acylethanolamine acid amidase (NAAA)

description: Small molecule binding data for protein N-acylethanolamine acid amidase (NAAA) and N-acylethanolamine-hydrolyzing acid amidase (NAAA), Uniprot Q02083 and Q5KTC7
DOI: 10.7270/q2445k6v
title: BindingDB Entry 6822: (aza)indole derivative and use thereof for medical purposes

description: Small molecule binding data for protein Xanthine dehydrogenase, Uniprot P80457
DOI: 10.7270/q25x27r0
title: BindingDB Entry 7435: Aggrecanase inhibitors

description: Small molecule binding data for protein A disintegrin and metalloproteinase with thrombospondin motifs 4 (ADAMTS-4), A disintegrin and metalloproteinase with thrombospondin motifs 5 (ADAMTS-5), Collagenase, Matrix Metalloproteinase-8 (MMP-8), Matrix metalloproteinase-1 (MMP1), Matrix metalloproteinase-12 (MMP12), Matrix metalloproteinase-14 (MMP14), Matrix metalloproteinase-7 (MMP7), Metalloproteinase with thrombospondin motifs 4 (ADAMTS-4), Metalloproteinase with thrombospondin motifs 5 (ADAMTS-5), and Stromelysin-1, Uniprot E2RFF5, G3V673, O75173, P03956, P08253, P08254, P09237, P14780, P22894, P39900, P45452, P50281, and Q9UNA0
DOI: 10.7270/q27w69xv
title: BindingDB Entry 6821: Substituted pyrrolidine-2-carboxamides

description: Small molecule binding data for protein E3 ubiquitin-protein ligase Mdm2, Uniprot Q00987
DOI: 10.7270/q29p30gq
title: BindingDB Entry 7434: Agent for treatment of eye diseases

description: Small molecule binding data for protein Valosin-containing protein (VCP), Uniprot Q01853
DOI: 10.7270/q2bp01hr
title: BindingDB Entry 6828: Synthesis, Biological Evaluation, and Molecular Simulation of Chalcones and Aurones as Selective MAO-B Inhibitors.

description: Small molecule binding data for protein Monoamine Oxidase Type B (MAO-B) and Monoamine oxidase, Uniprot P19643 and P21396
DOI: 10.7270/q2c24v9m
title: BindingDB Entry 8116: 3,5,N-trihydroxy-alkanamide and derivatives: method for making same and use thereof

description: Small molecule binding data for protein 3-hydroxy-3-methylglutaryl-coenzyme A reductase (HMG-CoA), Histone deacetylase, and Histone deacetylase 1, Uniprot A0A024QZ26, P04035, Q13547, Q92769, and Q9UBN7
DOI: 10.7270/q2d21wgf
title: BindingDB Entry 8107: Glutathione transferase from Plasmodium falciparum--interaction with malagashanine and selected plant natural products.

description: Small molecule binding data for protein Glutathione transferase (GST), Uniprot P09211 and V9HWE9
DOI: 10.7270/q2ff3r5m
title: BindingDB Entry 7433: Tricyclic amino containing compounds for treatment or prevention of symptoms associated with endocrine dysfunction

description: Small molecule binding data for protein C-X-C chemokine receptor type 4 (CXCR4/SDF-1), Uniprot O08565
DOI: 10.7270/q2gf0s73
title: BindingDB Entry 6827: Identification of Novel Selective Lysine-Specific Demethylase 1 (LSD1) Inhibitors Using a Pharmacophore-Based Virtual Screening Combined with Docking.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] A, Amine oxidase [flavin-containing] B, and Lysine-specific histone demethylase 1A, Uniprot O60341, P21397, and P27338
DOI: 10.7270/q2gt5m11
title: BindingDB Entry 8115: Indazole derivatives useful as ERK inhibitors

description: Small molecule binding data for protein Mitogen-activated protein kinase 1, Uniprot P63085
DOI: 10.7270/q2k64gvg
title: BindingDB Entry 7432: N-methyl-2-[3-((E)-2-pyridin-2-yl-vinyl)-1H-indazol-6-ylsulfanyl]-benzamide for the treatment of chronic myelogenous leukemia

description: Small molecule binding data for protein ABL Mutant (T315I) and Tyrosine-protein kinase ABL1, Uniprot P00519