cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q20r9q1r
title: BindingDB Entry 50036404: Metabotropic glutamate receptors: novel targets for drug development.

description: Small molecule binding data for protein GRM7, Metabotropic glutamate receptor, Metabotropic glutamate receptor 1, Metabotropic glutamate receptor 2 (mGluR2), Metabotropic glutamate receptor 3 (mGlu3), Metabotropic glutamate receptor 4 (mGlu4), Metabotropic glutamate receptor 4 (mGluR4), Metabotropic glutamate receptor 5, Metabotropic glutamate receptor 6 (mGlu6), Metabotropic glutamate receptor 7 (mGlu7), Metabotropic glutamate receptor 8, and metabotropic glutamate 1/2, Uniprot P23385, P31422, P31423, P31424, P35349, P35400, P41594, P47743, Q13255, Q14416, Q14831, and Q14833
DOI: 10.7270/q20z73np
title: BindingDB Entry 50033776: Structure-guided design and synthesis of P1' position 1-phenylcycloalkylamine-derived pentapeptidic BACE1 inhibitors.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q21v5fhj
title: BindingDB Entry 50035435: Synthesis and biological evaluation of novel, selective, nonsteroidal glucocorticoid receptor antagonists.

description: Small molecule binding data for protein Androgen Receptor, Estradiol receptor alpha (ERα), Glucocorticoid receptor, Mineralocorticoid receptor (MR), and Progesterone receptor, Uniprot P03372, P04150, P06401, P08235, and P10275
DOI: 10.7270/q22f7nxb
title: BindingDB Entry 50034643: 3,4-Diarylpiperidines as potent renin inhibitors.

description: Small molecule binding data for protein Renin and Voltage-gated potassium channel, Uniprot P00797 and Q12809
DOI: 10.7270/q24f1rd6
title: BindingDB Entry 50036403: Synthesis and evaluation of pharmacological and pharmacokinetic properties of monopropyl analogs of 5-, 7-, and 8-[[(trifluoromethyl)sulfonyl]oxy]-2-aminotetralins: central dopamine and serotonin receptor activity.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A (5HT1A), 5-hydroxytryptamine receptor 1D, Dopamine receptor, and Dopamine receptor D2L/neurotensin receptor NTS1, Uniprot P14416, P28221, P35462, and Q64264
DOI: 10.7270/q24m953w
title: BindingDB Entry 50035442: Carbonic anhydrase inhibitors: the first selective, membrane-impermeant inhibitors targeting the tumor-associated isozyme IX.

description: Small molecule binding data for protein Carbonic Anhydrase IV, Carbonic anhydrase, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot P00915, P00918, Q16790, and Q95323
DOI: 10.7270/q24q7vbk
title: BindingDB Entry 50033775: Design of benzimidazole- and benzoxazole-2-thione derivatives as inhibitors of bacterial hyaluronan lyase.

description: Small molecule binding data for protein Hyaluronate lyase, Uniprot Q54873
DOI: 10.7270/q25h7gtj
title: BindingDB Entry 50035434: Modified norcantharidins; synthesis, protein phosphatases 1 and 2A inhibition, and anticancer activity.

description: Small molecule binding data for protein Protein phosphatase 2C beta, Uniprot O75688
DOI: 10.7270/q2668dph
title: BindingDB Entry 50034642: Design, synthesis, and evaluation of novel 4-thiazolylimidazoles as inhibitors of transforming growth factor-ß type I receptor kinase.

description: Small molecule binding data for protein TGF-beta receptor type I, Uniprot P36897
DOI: 10.7270/q2862h3g
title: BindingDB Entry 50036402: Synthesis of alkyl chain-modified ether lipids and evaluation of their in vitro cytotoxicity.

description: Small molecule binding data for protein Platelet activating factor receptor, Uniprot P21556
DOI: 10.7270/q28916df
title: BindingDB Entry 50035441: Inactivation of gamma-aminobutyric acid aminotransferase by (S)-4-amino-4,5-dihydro-2-furancarboxylic acid does not proceed by the expected aromatization mechanism.

description: Small molecule binding data for protein Gamma-amino-N-butyrate transaminase, Uniprot P50554
DOI: 10.7270/q28c9wnk
title: BindingDB Entry 50033774: Discovery of atrop fixed alkoxy-aminobenzhydrol derivatives: novel, highly potent and orally efficacious squalene synthase inhibitors.

description: Small molecule binding data for protein Squalene synthetase, Uniprot Q02769
DOI: 10.7270/q29z95dx
title: BindingDB Entry 50034641: Imidazo[1,2-a]pyrazines as novel PI3K inhibitors.

description: Small molecule binding data for protein PI3-kinase subunit gamma, Phosphoinositide 3-Kinase (PI3K), delta, Serine/threonine-protein kinase mTOR, Voltage-gated potassium channel, and p110α/p85α, Uniprot O00329, P27986, P42336, P42345, P48736, and Q12809
DOI: 10.7270/q2cz37tg
title: BindingDB Entry 50036401: Ketanserin analogues: the effect of structural modification on 5-HT2 serotonin receptor binding.

description: Small molecule binding data for protein Serotonin (5-HT) receptor and Serotonin receptor 2a and 2c (5HT2A and 5HT2C), Uniprot P08909 and P14842
DOI: 10.7270/q2d21z4s
title: BindingDB Entry 50035440: Carbonic anhydrase inhibitors: inhibition of the tumor-associated isozyme IX with fluorine-containing sulfonamides. The first subnanomolar CA IX inhibitor discovered.

description: Small molecule binding data for protein Carbonic anhydrase, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot P00915, P00918, and Q16790
DOI: 10.7270/q2d50nbd
title: BindingDB Entry 50033773: Synthesis and molecular modeling of 1H-pyrrolopyrimidine-2,4-dione derivatives as ligands for thea1-adrenoceptors.

description: Small molecule binding data for protein Serotonin (5-HT) receptor, Uniprot P19327
DOI: 10.7270/q2fq9x48
title: BindingDB Entry 50034640: Anti-tumor activity of new orally bioavailable 2-amino-5-(thiophen-2-yl)benzamide-series histone deacetylase inhibitors, possessing an aqueous soluble functional group as a surface recognition domain.

description: Small molecule binding data for protein Histone deacetylase and Histone deacetylase 1, Uniprot Q13547 and Q92769
DOI: 10.7270/q2hq40kn
title: BindingDB Entry 50036400: Search for new purine- and ribose-modified adenosine analogues as selective agonists and antagonists at adenosine receptors.

description: Small molecule binding data for protein Adenosine Receptors A2a (A2a), Adenosine receptor A1, and Adenosine receptor A2a and A3, Uniprot P25099, P28647, and P30543
DOI: 10.7270/q2ht2pvs
title: BindingDB Entry 50035439: Synthesis and structure-activity relationship of 3-arylbenzoxazines as selective estrogen receptor beta agonists.

description: Small molecule binding data for protein Estradiol receptor alpha (ERα) and Estradiol receptor beta (ERβ), Uniprot P03372 and Q92731
DOI: 10.7270/q2hx1d2t
title: BindingDB Entry 50033772: Novel aminopeptidase N (APN/CD13) inhibitors derived from chloramphenicol amine.

description: Small molecule binding data for protein Aminopeptidase N and Collagenase, Uniprot P08253, P15144, and P15145
DOI: 10.7270/q2kh0ntp
title: BindingDB Entry 50034639: Discovery of 4-hydroxy-1,6-naphthyridine-3-carbonitrile derivatives as novel PDE10A inhibitors.

description: Small molecule binding data for protein Dihydroorotate dehydrogenase, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, cAMP-specific 3',5'-cyclic phosphodiesterase 4B, and cGMP-dependent 3',5'-cyclic phosphodiesterase, Uniprot O00408, Q02127, Q07343, and Q9Y233
DOI: 10.7270/q2mg7q5m
title: BindingDB Entry 50036407: Probes for narcotic receptor-mediated phenomena. 20. Alteration of opioid receptor subtype selectivity of the 5-(3-hydroxyphenyl)morphans by application of the message-address concept: preparation of delta-opioid receptor ligands.

description: Small molecule binding data for protein Delta-type opioid receptor, Nociceptin/mu opioid receptor, Opioid receptors; mu & delta, and mu/kappa opioid receptor, Uniprot P32300, P33533, P33535, P41144, and P97266
DOI: 10.7270/q2ng4r90
title: BindingDB Entry 50036399: Synthesis and in vitro activity of 17 beta-(N-alkyl/arylformamido)- and 17 beta-[(N-alkyl/aryl)alkyl/arylamido]-4-methyl-4-aza-3-oxo-5 alpha-androstan-3-ones as inhibitors of human 5 alpha-reductases and antagonists of the androgen receptor.

description: Small molecule binding data for protein 5α-Reductase 1 (5α-R1), Androgen Receptor, and Steroid 5-alpha-reductase, Uniprot P18405, P19091, and P31213
DOI: 10.7270/q2nk3fkh
title: BindingDB Entry 50035438: Novel halogenated nitrobenzylthioinosine analogs as es nucleoside transporter inhibitors.

description: Small molecule binding data for protein Equilibrative Nucleoside Transporter 1 (ENT1), Uniprot Q99808
DOI: 10.7270/q2np24tk
title: BindingDB Entry 50033771: Multi-target strategy to address Alzheimer's disease: design, synthesis and biological evaluation of new tacrine-based dimers.

description: Small molecule binding data for protein Acetylcholinesterase, Beta-secretase 1, and Cholinesterase, Uniprot P06276, P22303, and P56817
DOI: 10.7270/q2q52q3n
title: BindingDB Entry 50034638: 3,5-Disubstituted indole derivatives as selective human neuronal nitric oxide synthase (nNOS) inhibitors.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Nitric oxide synthase, brain, Nitric oxide synthase, inducible, Nitric-oxide synthase (endothelial and brain), and Nitric-oxide synthase, brain, Uniprot P05177, P08684, P10635, P11712, P29475, P29476, P33261, and P35228
DOI: 10.7270/q2rf5vdj
title: BindingDB Entry 50033778: Carbonic anhydrase inhibitors. Synthesis, molecular structures, and inhibition of the human cytosolic isozymes I and II and transmembrane isozymes IX, XII (cancer-associated) and XIV with novel 3-pyridinesulfonamide derivatives.

description: Small molecule binding data for protein Carbonic Anhydrase XIV, Carbonic anhydrase, Carbonic anhydrase 12, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot O43570, P00915, P00918, Q16790, and Q9ULX7
DOI: 10.7270/q2sb4697
title: BindingDB Entry 50035437: Solid-phase synthesis and SAR of 4-carboxy-2-azetidinone mechanism-based tryptase inhibitors.

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Plasmin, Prothrombin, Tissue-type plasminogen activator, Trypsin, Trypsin-1, and Urokinase-type plasminogen activator, Uniprot P00734, P00742, P00749, P00750, P00760, P07477, and Q01177
DOI: 10.7270/q2tx3ftn
title: BindingDB Entry 50034637: Development of live-cell imaging probes for monitoring histone modifications.

description: Small molecule binding data for protein Bromodomain testis-specific protein, Bromodomain-containing protein 2, Bromodomain-containing protein 3, Bromodomain-containing protein 4, and CREB-binding protein/p53, Uniprot O60885, P25440, Q15059, Q58F21, and Q92793
DOI: 10.7270/q2x34z1k
title: BindingDB Entry 50035436: Novel pyrrole-containing progesterone receptor modulators.

description: Small molecule binding data for protein Androgen Receptor and Progesterone receptor, Uniprot P06401 and P10275
DOI: 10.7270/q2x63nbj
title: BindingDB Entry 50033769: Design and discovery of a selective small molecule¿ opioid antagonist (2-methyl-N-((2'-(pyrrolidin-1-ylsulfonyl)biphenyl-4-yl)methyl)propan-1-amine, PF-4455242).

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/q2zp46kt
title: BindingDB Entry 50034635: 5-Aryl-4-carboxamide-1,3-oxazoles: potent and selective GSK-3 inhibitors.

description: Small molecule binding data for protein AKT/p21CIP1, Apoptosis Signal-regulating Kinase 1 (ASK1), Cyclin-dependent kinase 2, Epidermal growth factor receptor, Glycogen synthase kinase-3, Inhibitor of NF-kappa-B kinase (IKK), Insulin receptor, PAK1, Pyruvate dehydrogenase kinase isoenzyme 1 (PDK1), Rho-associated protein kinase, SRC, Serine/threonine-protein kinase AKT, Serine/threonine-protein kinase Aurora, TGF-beta receptor type I, Tyrosine-protein kinase ITK/TSK, Tyrosine-protein kinase SYK, Vascular endothelial growth factor receptor 2, and c-Jun N-terminal kinase, JNK, Uniprot O14920, O14965, P00533, P06213, P06239, P24941, P31749, P31751, P35968, P36897, P43405, P45983, P49841, Q08881, Q13153, Q13464, Q15118, and Q99683
DOI: 10.7270/q20v8dc5
title: BindingDB Entry 50035443: Synthesis and histone deacetylase inhibitory activity of cyclic tetrapeptides containing a retrohydroxamate as zinc ligand.

description: Small molecule binding data for protein Histone deacetylase, Histone deacetylase 1, Histone deacetylase 5, Histone deacetylase 6, and Histone deacetylase 8, Uniprot O09106, Q8VH37, Q9Z2V5, and Q9Z2V6
DOI: 10.7270/q21g0mqm
title: BindingDB Entry 50034651: JFCR39, a panel of 39 human cancer cell lines, and its application in the discovery and development of anticancer drugs.

description: Small molecule binding data for protein PI3-kinase subunit alpha, PI3-kinase subunit beta, PI3-kinase subunit delta, PI3-kinase subunit gamma, and Telomerase reverse transcriptase, Uniprot O00329, O14746, P42336, P42338, and P48736
DOI: 10.7270/q23j3dm7
title: BindingDB Entry 50036413: Design and synthesis of non-peptide Ras CAAX mimetics as potent farnesyltransferase inhibitors.

description: Small molecule binding data for protein Geranylgeranyl transferase type I beta subunit/Protein Farnesyltransferase (PFT) and Protein Farnesyltransferase (PFT), Uniprot P49354, P49356, and P53609
DOI: 10.7270/q23n23zn
title: BindingDB Entry 50035451: Synthesis of 1,3-diazepin-2-one nucleosides as transition-state inhibitors of cytidine deaminase.

description: Small molecule binding data for protein Cytidine deaminase and Cytidine deaminase (CDA), Uniprot P32320 and P56389
DOI: 10.7270/q23r0t8n
title: BindingDB Entry 50033783: DNA site-specific N3-adenine methylation targeted to estrogen receptor-positive cells.

description: Small molecule binding data for protein Estradiol receptor alpha (ERα), Uniprot P03372
DOI: 10.7270/q2571cgs
title: BindingDB Entry 50034650: New aromatase inhibitors from the 3-pyridyl arylether and 1-aryl pyrrolo[2,3-c]pyridine series.

description: Small molecule binding data for protein Aromatase (CYP19), Uniprot P11511
DOI: 10.7270/q2765g0j
title: BindingDB Entry 50036412: New sigma and 5-HT1A receptor ligands: omega-(tetralin-1-yl)-n-alkylamine derivatives.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A, NMDA receptor subunit 2C (GluN2C), OPIATE Sigma, Serotonin (5-HT) receptor, and Sigma, Uniprot P08908, P19327, Q00961, Q99720, and Q9R0C9
DOI: 10.7270/q27d2vp0
title: BindingDB Entry 50035449: Cyclophosphamide potentiation and aldehyde oxidase inhibition by phosphorylated aldehydes and acetals.

description: Small molecule binding data for protein Aldehyde oxidase, Uniprot Q06278
DOI: 10.7270/q27h1jzh
title: BindingDB Entry 50033782: Structure-based design of new DHFR-based antibacterial agents: 7-aryl-2,4-diaminoquinazolines.

description: Small molecule binding data for protein Dihydrofolate Reductase (DHFR) and Dihydrofolate reductase, Uniprot P00374 and P0A017
DOI: 10.7270/q290248d
title: BindingDB Entry 50034649: Discovery of vinylcycloalkyl-substituted benzimidazole TRPM8 antagonists effective in the treatment of cold allodynia.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Transient receptor potential M8 protein (TRPM8), and Transient receptor potential cation channel subfamily M member 8 (TRPM8), Uniprot P05177, P08684, P10635, P11712, P33261, Q1A7N1, Q7Z2W7, and Q8R455
DOI: 10.7270/q2bz66p3
title: BindingDB Entry 50036411: Structure-antigastrin activity relationships of new spiroglumide amido acid derivatives.

description: Small molecule binding data for protein Cholecystokinin receptor, Uniprot P30551 and P32239
DOI: 10.7270/q2c24x0d
title: BindingDB Entry 50035448: Inhibitors of polyamine biosynthesis. 8. Irreversible inhibition of mammalian S-adenosyl-L-methionine decarboxylase by substrate analogues.

description: Small molecule binding data for protein S-adenosylmethionine decarboxylase 1, Uniprot P17708
DOI: 10.7270/q2c53m7g
title: BindingDB Entry 50033781: Sesterterpenes from the tropical sponge Coscinoderma sp.

description: Small molecule binding data for protein Isocitrate lyase and Sortase A (SrtA), Uniprot Q9P8Q7
DOI: 10.7270/q2dr2w0f
title: BindingDB Entry 50034648: Aminopyrimidinone cdc7 kinase inhibitors.

description: Small molecule binding data for protein Activator of S phase kinase DBF4/Cell division cycle 7-related protein kinase, Uniprot O00311 and Q9UBU7
DOI: 10.7270/q2fq9x82
title: BindingDB Entry 50036418: Probes for narcotic receptor-mediated phenomena. 21. Novel derivatives of 3-(1,2,3,4,5,11-hexahydro-3-methyl-2,6-methano-6H-azocino[4,5-b]indol- 6-yl)-phenols with improved delta opioid receptor selectivity.

description: Small molecule binding data for protein Delta-type opioid receptor, Nociceptin/mu opioid receptor, Opioid receptors; mu & delta, and mu/kappa opioid receptor, Uniprot P32300, P33533, P33535, P41144, and P97266
DOI: 10.7270/q2gq6zdf
title: BindingDB Entry 50036409: Enantiomers of diastereomeric cis-N-[1-(2-hydroxy-2-phenylethyl)- 3-methyl-4-piperidyl]-N-phenylpropanamides: synthesis, X-ray analysis, and biological activities.

description: Small molecule binding data for protein Nociceptin/mu opioid receptor, Opioid receptors; mu & delta, and mu/kappa opioid receptor, Uniprot P33533, P33535, and P41144
DOI: 10.7270/q2gt5nqd
title: BindingDB Entry 50035447: 3-(4-Piperidinylalkyl)indoles, selective inhibitors of neuronal 5-hydroxytryptamine uptake.

description: Small molecule binding data for protein Dopamine Transporter (DAT), Norepinephrine Monoamine transporters, Serotonin and norepinephrine transporters (SERT/NET), and Sodium-dependent serotonin transporter, Uniprot P23977, P31645, and P31652
DOI: 10.7270/q2gx4bx1
title: BindingDB Entry 50033780: Halogen-substituted (C-ß-D-glucopyranosyl)-hydroquinone regioisomers: synthesis, enzymatic evaluation and their binding to glycogen phosphorylase.

description: Small molecule binding data for protein Glycogen phosphorylase, muscle form, Uniprot P00489
DOI: 10.7270/q2jh3mp9
title: BindingDB Entry 50034647: Synthesis and structure-activity relationship (SAR) study of 4-azabenzoxazole analogues as H3 antagonists.

description: Small molecule binding data for protein Histamine receptor (H3), Uniprot Q9Y5N1
DOI: 10.7270/q2kh0p0b
title: BindingDB Entry 50036417: Studies on selectin blockers. 2. Novel selectin blocker as potential therapeutics for inflammatory disorders.

description: Small molecule binding data for protein Leukocyte adhesion molecule-1, P-selectin/P-selectin glycoprotein ligand 1, and Selectin E, Uniprot A0A024R8Z0, P14151, P16109, and P16581
DOI: 10.7270/q2mk6df4
title: BindingDB Entry 50035446: Synthesis and pharmacological evaluation of 3-(3,4-dichlorophenyl)-1-indanamine derivatives as nonselective ligands for biogenic amine transporters.

description: Small molecule binding data for protein Dopamine Transporter (DAT), Norepinephrine Monoamine transporters, and Sodium-dependent serotonin transporter, Uniprot P23977 and P31652
DOI: 10.7270/q2mp53nr
title: BindingDB Entry 50033779: The natural product CCR5 antagonist anibamine and its analogs as anti-prostate cancer agents.

description: Small molecule binding data for protein C-C chemokine receptor type 5, Uniprot P51681
DOI: 10.7270/q2p84cck
title: BindingDB Entry 50034646: SAR-study on a new class of imidazo[1,2-a]pyridine-based inhibitors of 5-lipoxygenase.

description: Small molecule binding data for protein 5-lipoxygenase/FLAP, Uniprot P09917
DOI: 10.7270/q2r78fwx
title: BindingDB Entry 50036406: 2-Aralkynyl and 2-heteroalkynyl derivatives of adenosine-5'-N-ethyluronamide as selective A2a adenosine receptor agonists.

description: Small molecule binding data for protein Adenosine Receptors A2a (A2a) and Adenosine receptor A1, Uniprot P25099 and P30543
DOI: 10.7270/q2rb755v
title: BindingDB Entry 50035445: Oral bioavailability of a new class of micro-opioid receptor agonists containing 3,6-bis[Dmt-NH(CH(2))(n)]-2(1H)-pyrazinone with central-mediated analgesia.

description: Small molecule binding data for protein Delta-type opioid receptor, Nociceptin/mu opioid receptor, Opioid receptors; mu & delta, and mu/kappa opioid receptor, Uniprot P32300, P33533, P33535, P41143, and P97266
DOI: 10.7270/q2sx6dqq
title: BindingDB Entry 50034645: Structure-activity relationship of the 7-hydroxy benzimidazole analogs as glycogen synthase kinase 3ß inhibitor.

description: Small molecule binding data for protein Glycogen synthase kinase-3, Uniprot P49841
DOI: 10.7270/q2v125gt
title: BindingDB Entry 50036415: Studies of cardiotonic agents. 8. Synthesis and biological activities of optically active 6-(4-(benzylamino)-7-quinazolinyl)-4,5-dihydro-5-methyl-3(2H)- pyridazinone (KF15232).

description: Small molecule binding data for protein Heart phosphodiesterase and Phosphodiesterase 5A, Uniprot Q28156
DOI: 10.7270/q2v69jz1
title: BindingDB Entry 50033785: The structure-activity relationship of urea derivatives as anti-tuberculosis agents.

description: Small molecule binding data for protein Epoxide Hydrolase B (EHB), Epoxide hydratase, and Hydrolase, alpha/beta hydrolase fold family, Uniprot P34913 and P95276
DOI: 10.7270/q2w096k6
title: BindingDB Entry 50036405: Synthesis and in vitro evaluation of 4-substituted N-(1,1-dimethylethyl)-3-oxo-4-androstene-17 beta-carboxamides as 5 alpha-reductase inhibitors and antiandrogens.

description: Small molecule binding data for protein 5α-Reductase 1 (5α-R1) and Steroid 5-alpha-reductase, Uniprot P18405 and P31213
DOI: 10.7270/q2w37wws
title: BindingDB Entry 50035444: Design and synthesis of bridged gamma-lactams as analogues of beta-lactam antibiotics.

description: Small molecule binding data for protein Beta-lactamase AmpC, Uniprot P00811
DOI: 10.7270/q2w66m5q
title: BindingDB Entry 50033777: 3-benzhydryl-4-piperidones as novel neurokinin-1 receptor antagonists and their efficient synthesis.

description: Small molecule binding data for protein Neurokinin 1 receptor, Uniprot P25103
DOI: 10.7270/q2xp75d0
title: BindingDB Entry 50034644: Identification of fused bicyclic heterocycles as potent and selective 5-HT(2A) receptor antagonists for the treatment of insomnia.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 2C (5-HT2C), Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Voltage-gated potassium channel, Uniprot P05177, P08684, P10635, P11712, P28223, P28335, P33261, and Q12809
DOI: 10.7270/q2zs2x6v
title: BindingDB Entry 50036414: Theoretical study of inhibition of adenosine deaminase by (8R)-coformycin and (8R)-deoxycoformycin.

description: Small molecule binding data for protein Adenosine deaminase, Uniprot P00813
DOI: 10.7270/q2zw1mgc
title: BindingDB Entry 50035456: Synthesis and angiotensin-converting enzyme inhibitory activity of 3-(Mercaptomethyl)-2-oxo-1-pyrrolidineacetic acids and 3-(Mercaptomethyl)-2-oxo-1-piperidineacetic acids.

description: Small molecule binding data for protein Angiotensin-Converting Enzyme 2, Uniprot P12821 and Q9BYF1
DOI: 10.7270/q20002gq
title: BindingDB Entry 50033784: Synthesis of various 3-nitropropionamides as Mycobacterium tuberculosis isocitrate lyase inhibitor.

description: Small molecule binding data for protein Isocitrate lyase (ICL), Uniprot P9WKK7
DOI: 10.7270/q20g3kmp
title: BindingDB Entry 50034659: Substituted azaquinazolinones as modulators of GHSr-1a for the treatment of type II diabetes and obesity.

description: Small molecule binding data for protein Ghrelin receptor and Voltage-gated potassium channel, Uniprot Q12809 and Q92847
DOI: 10.7270/q22j6cjr
title: BindingDB Entry 50036421: 2-Phenyl-4-quinolinecarboxamides: a novel class of potent and selective non-peptide competitive antagonists for the human neurokinin-3 receptor.

description: Small molecule binding data for protein Neurokinin 1 receptor, Neurokinin 2 receptor, Neurokinin 3 receptor, TACR2, and TACR3, Uniprot P16610, P21452, P25103, P29371, and P30098