cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2df6rhx
title: BindingDB Entry 50032857: Structure-based design of potent and selective 2-(quinazolin-2-yl)phenol inhibitors of checkpoint kinase 2.

description: Small molecule binding data for protein Serine/threonine-protein kinase CHK2 and Serine/threonine-protein kinase Chk1, Uniprot O14757 and O96017
DOI: 10.7270/q2dj5g84
title: BindingDB Entry 50036266: Structure-affinity relationship studies on 5-HT1A receptor ligands. 2. Heterobicyclic phenylpiperazines with N4-aralkyl substituents.

description: Small molecule binding data for protein Serotonin (5-HT) receptor, Uniprot P19327
DOI: 10.7270/q2gb24j0
title: BindingDB Entry 50034514: Selective and slow-binding inhibition of shikonin derivatives isolated from Lithospermum erythrorhizon on glycosyl hydrolase 33 and 34 sialidases.

description: Small molecule binding data for protein Neuraminidase, Uniprot Q9IGQ6
DOI: 10.7270/q2gh9jbn
title: BindingDB Entry 50033655: Rigidized 1-aryl sulfonyl tryptamines: synthesis and pharmacological evaluation as 5-HT6 receptor ligands.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 6 (5-HT6), Cytochrome P450 2D6 (2D6), and Cytochrome P450 3A, Uniprot P08684, P10635, and P50406
DOI: 10.7270/q2hd7w6h
title: BindingDB Entry 50035313: Identification of oxidation product of arbutin in mushroom tyrosinase assay system.

description: Small molecule binding data for protein Tyrosinase, Uniprot P14679
DOI: 10.7270/q2j67h7n
title: BindingDB Entry 50032856: Discovery and SAR of 5-(3-chlorophenylamino)benzo[c][2,6]naphthyridine-8-carboxylic acid (CX-4945), the first clinical stage inhibitor of protein kinase CK2 for the treatment of cancer.

description: Small molecule binding data for protein CDC2-like kinase 3 (CLK3), Casein Kinase II, Cyclin B/Cyclin-Dependent Kinase 1 (CDK1)/G2/mitotic-specific cyclin B2/G2/mitotic-specific cyclin B3, Death-associated protein kinase 3, Homeodomain-interacting protein kinase 3, IKK epsilon/TBK1, Serine/threonine-protein kinase PIM, Tyrosine-protein kinase receptor FLT3, and poly-ADP-ribose polymerase 1 (PARP1), Uniprot O43293, O95067, P06493, P09874, P11309, P14635, P36888, P49761, P68400, Q8WWL7, Q9H422, and Q9UHD2
DOI: 10.7270/q2j96719
title: BindingDB Entry 50036265: Substituted (S)-phenylpiperidines and rigid congeners as preferential dopamine autoreceptor antagonists: synthesis and structure-activity relationships.

description: Small molecule binding data for protein Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor, Dopamine receptor, Dopamine receptor D2L/neurotensin receptor NTS1, and Serotonin (5-HT) receptor, Uniprot P14416, P19020, P19327, P35462, and P61169
DOI: 10.7270/q2m32w7w
title: BindingDB Entry 50034513: QSAR studies for prediction of cross-ß sheet aggregate binding affinity and selectivity.

description: Small molecule binding data for protein Insulin receptor, Uniprot P06213
DOI: 10.7270/q2m9091g
title: BindingDB Entry 50033654: N-ß-glycosyl sulfamides are selective inhibitors of the cancer associated carbonic anhydrase isoforms IX and XII.

description: Small molecule binding data for protein Carbonic anhydrase, Carbonic anhydrase 12, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot O43570, P00915, P00918, and Q16790
DOI: 10.7270/q2n58mwc
title: BindingDB Entry 50035312: Synthesis and inhibitory activity of ubiquinone-acetogenin hybrid inhibitor with bovine mitochondrial complex I.

description: Small molecule binding data for protein Mitochondrial complex I; NADH oxidoreductase, Uniprot P25708 and P52505
DOI: 10.7270/q2p26zsp
title: BindingDB Entry 50036264: Discovery of nanomolar ligands for 7-transmembrane G-protein-coupled receptors from a diverse N-(substituted)glycine peptoid library.

description: Small molecule binding data for protein Nociceptin/mu opioid receptor, Uniprot P33535
DOI: 10.7270/q2qr4xk1
title: BindingDB Entry 50034512: Synthesis and evaluation of non-basic inhibitors of urokinase-type plasminogen activator (uPA).

description: Small molecule binding data for protein Plasminogen, Prothrombin, Tissue-type plasminogen activator, and Urokinase-type plasminogen activator, Uniprot P00734, P00747, P00749, and P00750
DOI: 10.7270/q2r211rs
title: BindingDB Entry 50033653: Synthesis and SAR of new pyrazolo[4,3-h]quinazoline-3-carboxamide derivatives as potent and selective MPS1 kinase inhibitors.

description: Small molecule binding data for protein Cyclin-Dependent Kinase 2 (CDK2), Dual specificity protein kinase TTK, Serine/threonine-protein kinase Aurora, and Serine/threonine-protein kinase PLK1, Uniprot O14965, P20248, P24941, P33981, and P53350
DOI: 10.7270/q2rr1zhq
title: BindingDB Entry 50032862: Synthesis and molecular modeling of novel tetrahydro-ß-carboline derivatives with phosphodiesterase 5 inhibitory and anticancer properties.

description: Small molecule binding data for protein Phosphodiesterase 11A (PDE11A), cAMP-specific 3',5'-cyclic phosphodiesterase 4B, cGMP-inhibited 3',5'-cyclic phosphodiesterase B, and cGMP-specific 3',5'-cyclic phosphodiesterase, Uniprot O76074, Q07343, Q13370, and Q9HCR9
DOI: 10.7270/q2rx9cms
title: BindingDB Entry 50035311: Polymer-assisted solution-phase (PASP) parallel synthesis of an alpha-ketothiazole library as tissue factor VIIa inhibitors.

description: Small molecule binding data for protein Coagulation factor VII, Coagulation factor X/antithrombin III, and Prothrombin, Uniprot P00734, P00742, and P08709
DOI: 10.7270/q2st7qgn
title: BindingDB Entry 50036263: 2,6-Disubstituted aryl carboxylic acids, leaving groups"par excellence" for benzisothiazolone inhibitors of human leukocyte elastase.

description: Small molecule binding data for protein Leukocyte elastase, Uniprot P08246
DOI: 10.7270/q2vh5p89
title: BindingDB Entry 50034511: Cloning, characterization and sulfonamide inhibition studies of ana-carbonic anhydrase from the living fossil sponge Astrosclera willeyana.

description: Small molecule binding data for protein Astrosclerin-3, Carbonic anhydrase, and Carbonic anhydrase 2, Uniprot P00915 and P00918
DOI: 10.7270/q2vq336p
title: BindingDB Entry 50035318: Structure--activity relationships of the peptide deformylase inhibitor BB-3497: modification of the P2' and P3' side chains.

description: Small molecule binding data for protein Peptide deformylase
DOI: 10.7270/q2vt1sgt
title: BindingDB Entry 50033652: Identification of benzofuran-4,5-diones as novel and selective non-hydroxamic acid, non-peptidomimetic based inhibitors of human peptide deformylase.

description: Small molecule binding data for protein Peptide deformylase and Peptide deformylase mitochondrial, Uniprot Q9HBH1
DOI: 10.7270/q2wh2q7f
title: BindingDB Entry 50032861: New drug-like hydroxyphenylnaphthol steroidomimetics as potent and selective 17ß-hydroxysteroid dehydrogenase type 1 inhibitors for the treatment of estrogen-dependent diseases.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2B6, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Estradiol 17-beta-dehydrogenase 1 (17beta-HSD1), and Estradiol 17-beta-dehydrogenase 2, Uniprot P05177, P08684, P10635, P11712, P14061, P20813, P33261, and P37059
DOI: 10.7270/q2wq04b2
title: BindingDB Entry 50035309: 1,7- and 2,7-naphthyridine derivatives as potent and highly specific PDE5 inhibitors.

description: Small molecule binding data for protein Phosphodiesterase 2A and cGMP-specific 3',5'-cyclic phosphodiesterase, Uniprot O77746 and P14099
DOI: 10.7270/q2xk8g5x
title: BindingDB Entry 50036261: Inhibitors of acyl-CoA:cholesterol O-acyltransferase. 11. Structure-activity relationships of several series of compounds derived from N-(chlorocarbonyl) isocyanate.

description: Small molecule binding data for protein Acyl-CoA:cholesterol acyltransferase
DOI: 10.7270/q20865kb
title: BindingDB Entry 50032874: 1-(1-acetyl-piperidin-4-yl)-3-adamantan-1-yl-urea (AR9281) as a potent, selective, and orally available soluble epoxide hydrolase inhibitor with efficacy in rodent models of hypertension and dysglycemia.

description: Small molecule binding data for protein Epoxide hydratase and Soluble epoxide hydrolase (sEH), Uniprot P34913 and P34914
DOI: 10.7270/q21c1xh0
title: BindingDB Entry 50036269: Synthesis, ligand binding, and QSAR (CoMFA and classical) study of 3 beta-(3'-substituted phenyl)-, 3 beta-(4'-substituted phenyl)-, and 3 beta-(3',4'-disubstituted phenyl)tropane-2 beta-carboxylic acid methyl esters.

description: Small molecule binding data for protein Dopamine Transporter (DAT), Uniprot P23977
DOI: 10.7270/q237798x
title: BindingDB Entry 50035325: Thymidine and thymidine-5'-O-monophosphate analogues as inhibitors of Mycobacterium tuberculosis thymidylate kinase.

description: Small molecule binding data for protein Thymidylate kinase, Uniprot P9WKE1
DOI: 10.7270/q23x86xg
title: BindingDB Entry 50032873: The discovery of furo[2,3-c]pyridine-based indanone oximes as potent and selective B-Raf inhibitors.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, and Cytochrome P450 3A, Uniprot P05177, P08684, and P33261
DOI: 10.7270/q25t3kxq
title: BindingDB Entry 50034524: Inhibition of monoamine oxidase by selected C6-substituted chromone derivatives.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] A and Amine oxidase [flavin-containing] B, Uniprot P21397 and P27338
DOI: 10.7270/q2639q3z
title: BindingDB Entry 50033665: Identification of MK-5710 ((8aS)-8a-methyl-1,3-dioxo-2-[(1S,2R)-2-phenylcyclopropyl]-N-(1-phenyl-1H-pyrazol-5-yl)hexahydroimid azo[1,5-a]pyrazine-7(1H)-carboxamide), a potent smoothened antagonist for use in Hedgehog pathway dependent malignancies, part 1.

description: Small molecule binding data for protein G-protein- coupled-like receptor Smoothened (Smo), Uniprot Q99835
DOI: 10.7270/q270820n
title: BindingDB Entry 50035324: 2,6,8,9-tetrasubstituted purines as new CDK1 inhibitors.

description: Small molecule binding data for protein Cyclin-dependent kinase 1, Uniprot P06493
DOI: 10.7270/q27p8znt
title: BindingDB Entry 50032872: Sodium [2'-[(cyclopropanecarbonyl-ethyl-amino)-methyl]-4'-(6-ethoxy-pyridin-3-yl)-6-methoxy-biphenyl-3-yl]-acetate (AM432): a potent, selective prostaglandin D2 receptor antagonist.

description: Small molecule binding data for protein Cyclooxygenase, Cyclooxygenase-1 (COX-1), Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, G protein-coupled receptor 44, Peroxisome proliferator-activated receptor alpha (PPAR alpha), Prostanoid DP receptor, Prostanoid IP receptor, and Prostanoid TP receptor, Uniprot P05177, P08684, P10635, P11712, P21731, P23219, P33261, P35354, P43119, Q07869, Q13258, and Q9Y5Y4
DOI: 10.7270/q27s7pd1
title: BindingDB Entry 50036275: Evaluation of a vitamin-cloaking strategy for oligopeptide therapeutics: biotinylated HIV-1 protease inhibitors.

description: Small molecule binding data for protein Human immunodeficiency virus type 1 protease
DOI: 10.7270/q29k4bpw
title: BindingDB Entry 50034523: Design, synthesis and biological evaluation of 6-substituted aminocarbonyl benzimidazole derivatives as nonpeptidic angiotensin II AT1 receptor antagonists.

description: Small molecule binding data for protein Angiotensin II receptor and Angiotensin II type 1a (AT-1a) receptor, Uniprot P30556, P34976, and P50052
DOI: 10.7270/q29w0fvz
title: BindingDB Entry 50033664: C-aryl glucosides substituted at the 4'-position as potent and selective renal sodium-dependent glucose co-transporter 2 (SGLT2) inhibitors for the treatment of type 2 diabetes.

description: Small molecule binding data for protein Sodium/glucose cotransporter 1 (SGLT1) and Sodium/glucose cotransporter 2 (SGLT2), Uniprot P13866 and P31639
DOI: 10.7270/q2bk1ct8
title: BindingDB Entry 50034515: Synthesis, molecular docking and biological evaluation of 1,3,4-oxadiazole derivatives as potential immunosuppressive agents.

description: Small molecule binding data for protein PI3-kinase subunit gamma, Uniprot P48736
DOI: 10.7270/q2br8sq8
title: BindingDB Entry 50035322: Carbonic anhydrase inhibitors: topically acting antiglaucoma sulfonamides incorporating esters and amides of 3- and 4-carboxybenzolamide.

description: Small molecule binding data for protein Carbonic Anhydrase IV, Carbonic anhydrase, and Carbonic anhydrase 2, Uniprot P00915, P00918, and Q95323
DOI: 10.7270/q2cf9qcj
title: BindingDB Entry 50032871: Three-dimensional quantitative structure-selectivity relationships analysis guided rational design of a highly selective ligand for the cannabinoid receptor 2.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot P21554 and P34972
DOI: 10.7270/q2cj8f39
title: BindingDB Entry 50036274: Synthesis and pharmacological evaluation of phenylacetamides as sodium-channel blockers.

description: Small molecule binding data for protein Sodium channel protein type II alpha subunit, Uniprot P04775
DOI: 10.7270/q2fb53dm
title: BindingDB Entry 50034522: Synthesis and biological evaluation of quinazoline and quinoline bearing 2,2,6,6-tetramethylpiperidine-N-oxyl as potential epidermal growth factor receptor(EGFR) tyrosine kinase inhibitors and EPR bio-probe agents.

description: Small molecule binding data for protein Epidermal growth factor receptor, Uniprot P00533
DOI: 10.7270/q2fn16j7
title: BindingDB Entry 50033663: Discovery and synthesis of a new class of opioid ligand having a 3-azabicyclo[3.1.0]hexane core. An example of a 'magic methyl' giving a 35-fold improvement in binding.

description: Small molecule binding data for protein Mu-type opioid receptor, Uniprot P35372
DOI: 10.7270/q2gf0v2p
title: BindingDB Entry 50035321: Design and synthesis of potent and selective macrocyclic thrombin inhibitors.

description: Small molecule binding data for protein Prothrombin, Tissue-type plasminogen activator, and Trypsin-1, Uniprot P00734, P00750, and P07477
DOI: 10.7270/q2h70g3t
title: BindingDB Entry 50032870: Angiotensin II receptor type 1 (AT1) selective nonpeptidic antagonists--a perspective.

description: Small molecule binding data for protein Angiotensin II receptor, Angiotensin II type 1a (AT-1a) receptor, and Type-1 angiotensin II receptor, Uniprot P25104, P30556, P34976, P50052, and Q9WV26
DOI: 10.7270/q2h995tm
title: BindingDB Entry 50036273: Enhanced selectivity of oxytocin antagonists containing sarcosine in position 7.

description: Small molecule binding data for protein AVPR2 and Oxytocin receptor, Uniprot P30559 and P48044
DOI: 10.7270/q2k35v4z
title: BindingDB Entry 50034521: Synthesis, in vitro binding studies and docking of long-chain arylpiperazine nitroquipazine analogues, as potential serotonin transporter inhibitors.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A, Serotonin and norepinephrine transporters (SERT/NET), and Sodium-dependent serotonin transporter, Uniprot P08908, P31645, and P31652
DOI: 10.7270/q2k937wp
title: BindingDB Entry 50033662: Design, synthesis and biological evaluation of tyrosine-based hydroxamic acid analogs as novel histone deacetylases (HDACs) inhibitors.

description: Small molecule binding data for protein Histone deacetylase 8, Uniprot Q9BY41
DOI: 10.7270/q2m61ks0
title: BindingDB Entry 50035320: Novel 3-O-acyl mesquitol analogues as free-radical scavengers and enzyme inhibitors: synthesis, biological evaluation and structure-activity relationship.

description: Small molecule binding data for protein Xanthine oxidase, Uniprot P47989
DOI: 10.7270/q2n016t4
title: BindingDB Entry 50032863: Inhibition of lymphoid tyrosine phosphatase by benzofuran salicylic acids.

description: Small molecule binding data for protein Hematopoietic protein-tyrosine phosphatase (HEPTP), Protein-tyrosine phosphatase 1B, Protein-tyrosine phosphatase 1C, Receptor-type tyrosine-protein phosphatase F (LAR), Tyrosine-Protein Phosphatase (CD45), and Tyrosine-protein phosphatase non-receptor type 22, Uniprot P08575, P10586, P18031, P29350, P35236, and Q9Y2R2
DOI: 10.7270/q2n29xkd
title: BindingDB Entry 50036272: 3-substituted thieno[2,3-b][1,4]thiazine-6-sulfonamides. A novel class of topically active carbonic anhydrase inhibitors.

description: Small molecule binding data for protein Carbonic anhydrase 2, Uniprot P00918
DOI: 10.7270/q2pv6kth
title: BindingDB Entry 50034520: Synthesis of chromeno[3,4-b]indoles as Lamellarin D analogues: a novel DYRK1A inhibitor class.

description: Small molecule binding data for protein Cyclin-Dependent Kinase 5 (CDK5) and Dual-specificity tyrosine-(Y)-phosphorylation regulated kinase 1A, Uniprot Q00535, Q15078, and Q63470
DOI: 10.7270/q2q240kz
title: BindingDB Entry 50033661: Development of potent B-RafV600E inhibitors containing an arylsulfonamide headgroup.

description: Small molecule binding data for protein Activin receptor type-2B, Nuclear receptor coactivator 1, Receptor tyrosine-protein kinase erbB-4 (HER4), SRC, TGF-beta receptor type I, and Tyrosine-protein kinase BTK, Uniprot P06239, P07948, P36897, Q06187, Q13705, Q15303, and Q15788
DOI: 10.7270/q2qr4xds
title: BindingDB Entry 50032876: Structure-based parallel medicinal chemistry approach to improve metabolic stability of benzopyran COX-2 inhibitors.

description: Small molecule binding data for protein Cyclooxygenase and Cyclooxygenase-1 (COX-1), Uniprot P23219 and P35354
DOI: 10.7270/q2qz2bgz
title: BindingDB Entry 50035319: Prediction of hERG potassium channel affinity by traditional and hologram qSAR methods.

description: Small molecule binding data for protein Voltage-gated potassium channel, Uniprot Q12809
DOI: 10.7270/q2rv0pbt
title: BindingDB Entry 50036271: Estrone sulfamates: potent inhibitors of estrone sulfatase with therapeutic potential.

description: Small molecule binding data for protein Steroid Sulfatase (STS), Uniprot P08842
DOI: 10.7270/q2th8n5c
title: BindingDB Entry 50034519: Synthesis and biological characterisation of sirtuin inhibitors based on the tenovins.

description: Small molecule binding data for protein NAD-Dependent Deacetylase Sirtuin-1 and NAD-dependent deacetylase sirtuin 2, Uniprot Q8IXJ6 and Q96EB6
DOI: 10.7270/q2tq6229
title: BindingDB Entry 50035327: O-arylmandelic acids as highly selective human PPAR alpha/gamma agonists.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Peroxisome proliferator-activated receptor alpha, and Peroxisome proliferator-activated receptor alpha (PPAR alpha), Uniprot P23204, P37231, and Q07869
DOI: 10.7270/q2tt4r90
title: BindingDB Entry 50033660: Azepanone-based inhibitors of human cathepsin S: optimization of selectivity via the P2 substituent.

description: Small molecule binding data for protein Cathepsin K, Cathepsin L1, and Cathepsin S, Uniprot P07711, P25774, and P43235
DOI: 10.7270/q2vh5p4h
title: BindingDB Entry 50032875: Naphthalene/quinoline amides and sulfonylureas as potent and selective antagonists of the EP4 receptor.

description: Small molecule binding data for protein Prostaglandin E2 receptor EP4 subtype (EP4), Uniprot P35408
DOI: 10.7270/q2wm1f2j
title: BindingDB Entry 50036270: Novel dual inhibitors of 5-lipoxygenase and thromboxane A2 synthetase: synthesis and structure-activity relationships of 3-pyridylmethyl-substituted 2-amino-6-hydroxybenzothiazole derivatives.

description: Small molecule binding data for protein Arachidonate 5-lipoxygenase, LTB4R, Thromboxane A2 Synthase (P450 TxA2), and Thromboxane-A synthase, Uniprot P12527, P24557, P49430, and Q15722
DOI: 10.7270/q2z89cv7
title: BindingDB Entry 50034518: Investigation of trypanothione reductase inhibitory activity by 1,3,4-thiadiazolium-2-aminide derivatives and molecular docking studies.

description: Small molecule binding data for protein Trypanothione reductase
DOI: 10.7270/q2zg6ss7
title: BindingDB Entry 50035326: Potent small molecule inhibitors of spleen tyrosine kinase (Syk).

description: Small molecule binding data for protein Immunoglobulin epsilon Fc receptor and Tyrosine-protein kinase SYK, Uniprot P06734 and P43405
DOI: 10.7270/q2zk5h1q
title: BindingDB Entry 50033659: Nothospondin, a new AP-1 inhibitory quassinoid from the Cameroonian plant Nothospondias staudtii.

description: Small molecule binding data for protein Transcription factor AP-1, Uniprot P05412
DOI: 10.7270/q20c4wfh
title: BindingDB Entry 50036277: A new approach to the design of sigma-2-selective ligands: synthesis and evaluation of N-[2-(3,4-dichlorophenyl)ethyl]-N-methyl-2-(1- pyrrolidinyl)ethylamine-related polyamines at sigma-1 and sigma-2 receptor subtypes.

description: Small molecule binding data for protein Sigma, Uniprot Q99720
DOI: 10.7270/q2125t47
title: BindingDB Entry 50034533: Discovery of substituted biphenyl oxazolidinone inhibitors of cholesteryl ester transfer protein.

description: Small molecule binding data for protein Cholesteryl ester transfer protein, Uniprot P11597
DOI: 10.7270/q21c1x7d
title: BindingDB Entry 50033674: Discovery of vinylogous carbamates as a novel class ofß-ketoacyl-acyl carrier protein synthase III (FabH) inhibitors.

description: Small molecule binding data for protein Beta-ketoacyl-ACP synthase III (FabH), Uniprot C3TDZ2
DOI: 10.7270/q2222v6q
title: BindingDB Entry 50034525: AlCl3 induced (hetero)arylation of 2,3-dichloroquinoxaline: a one-pot synthesis of mono/disubstituted quinoxalines as potential antitubercular agents.

description: Small molecule binding data for protein Chorismate mutase (MTB CM), Uniprot P9WIB9
DOI: 10.7270/q228085j
title: BindingDB Entry 50035334: Design and synthesis of novel CCR3 antagonists.

description: Small molecule binding data for protein C-C chemokine receptor type 1 and C-C chemokine receptor type 3, Uniprot P32246 and P51677
DOI: 10.7270/q22b8zc7
title: BindingDB Entry 50033666: Synthesis, in vitro and in vivo evaluation of fluorine-18 labelled FE-GW405833 as a PET tracer for type 2 cannabinoid receptor imaging.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot P21554 and P34972
DOI: 10.7270/q2319w59
title: BindingDB Entry 50032882: Influence of pKa on the biotransformation of indene H1-antihistamines by CYP2D6.

description: Small molecule binding data for protein Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Histamine H1 receptor, Uniprot P08684, P10635, and P35367
DOI: 10.7270/q2348m1v
title: BindingDB Entry 50036286: 2-Substitution of N6-benzyladenosine-5'-uronamides enhances selectivity for A3 adenosine receptors.

description: Small molecule binding data for protein Adenosine Receptors A2a (A2a), Adenosine receptor A1, Adenosine receptor A2a and A3, and Equilibrative nucleoside transporter 1, Uniprot O54698, P25099, P28647, and P30543
DOI: 10.7270/q2445n4s
title: BindingDB Entry 50036276: Tetrapeptide CCK agonists: structure-activity studies on modifications at the N-terminus.

description: Small molecule binding data for protein Cholecystokinin A receptor and Cholecystokinin receptor, Uniprot P32239 and Q63931
DOI: 10.7270/q24t6jts
title: BindingDB Entry 50034532: Discovery of CS-0777: A Potent, Selective, and Orally Active S1P1 Agonist.

description: Small molecule binding data for protein Sphingosine 1-Phosphate Receptor 5, Sphingosine 1-phosphate receptor, Sphingosine 1-phosphate receptor 1, and Sphingosine 1-phosphate receptor 3, Uniprot P21453, P48303, Q99500, and Q9H228
DOI: 10.7270/q2542nzq
title: BindingDB Entry 50033673: The design, synthesis and structure-activity relationships of novel isoindoline-based histone deacetylase inhibitors.

description: Small molecule binding data for protein Cytochrome P450 3A, Histone deacetylase 1, and Voltage-gated potassium channel, Uniprot P08684, Q12809, and Q13547
DOI: 10.7270/q26110wv
title: BindingDB Entry 50035333: Synthesis and pharmacological evaluation of (Z)-9-(heteroarylmethylene)-7-azatricyclo[4.3.1.0(3,7)]decanes: thiophene analogues as potent norepinephrine transporter inhibitors.

description: Small molecule binding data for protein Dopamine Transporter (DAT), Norepinephrine Monoamine transporters, and Sodium-dependent serotonin transporter, Uniprot P23977 and P31652