cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2j38s6v
title: BindingDB Entry 50019064: Constrained 7-fluorocarboxychromone-4-aminopiperidine based Melanin-concentrating hormone receptor 1 antagonists: the effects of chirality on substituted indan-1-ylamines.

description: Small molecule binding data for protein GPR145, Melanin-concentrating hormone receptor, and Voltage-gated potassium channel, Uniprot Q12809, Q969V1, and Q99705
DOI: 10.7270/q2k073xw
title: BindingDB Entry 50019033: N1-substituted thymine derivatives as mitochondrial thymidine kinase (TK-2) inhibitors.

description: Small molecule binding data for protein Deoxynucleoside kinase, Thymidine kinase, and Thymidine kinase, mitochondrial, Uniprot O00142 and Q9XZT6
DOI: 10.7270/q2k07423
title: BindingDB Entry 50026800: Synthesis and pharmacological evaluation of hydrophobic esters and ethers of butorphanol at opioid receptors.

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/q2k64hn6
title: BindingDB Entry 50017016: Synthesis and SAR of highly potent and selective dopamine D(3)-receptor antagonists: Quinolin(di)one and benzazepin(di)one derivatives. herve.geneste@abbott.com.

description: Small molecule binding data for protein Dopamine D1 and D2 receptor, Dopamine D5 receptor, Dopamine receptor, and Dopamine receptor D2L/neurotensin receptor NTS1, Uniprot P14416, P21728, P21918, and P35462
DOI: 10.7270/q2ns0tjj
title: BindingDB Entry 50019061: Discovery of novel hydantoins as selective non-hydroxamate inhibitors of tumor necrosis factor-alpha converting enzyme (TACE).

description: Small molecule binding data for protein ADAM17, Collagenase, and Matrix metalloproteinase-1 (MMP1), Uniprot O77636, P03956, P08253, P14780, and P45452
DOI: 10.7270/q2p55n8w
title: BindingDB Entry 50021888: Novel heterocycle-substituted pyrimidines as inhibitors of NF-kappaB transcription regulation related to TNF-alpha cytokine release.

description: Small molecule binding data for protein Glycogen synthase kinase-3, Uniprot P49841
DOI: 10.7270/q2pr7vsq
title: BindingDB Entry 50026799: Synthesis and biological evaluation of N-mercaptoacylproline and N-mercaptoacylthiazolidine-4-carboxylic acid derivatives as leukotriene A4 hydrolase inhibitors.

description: Small molecule binding data for protein Angiotensin-converting enzyme, Leukotriene A-4 hydrolase, and Leukotriene A4 hydrolase, Uniprot P09960, P12821, and P19602
DOI: 10.7270/q2pz58cm
title: BindingDB Entry 50017014: Synthesis of functionalized 1,8-naphthyridinones and their evaluation as novel, orally active CB1 receptor inverse agonists.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot P21554 and P34972
DOI: 10.7270/q2rx9bt2
title: BindingDB Entry 50021938: Conformational comparisons of a series of tachykinin peptide analogs.

description: Small molecule binding data for protein Neurokinin 1 receptor, Uniprot P14600
DOI: 10.7270/q2sj1k7t
title: BindingDB Entry 50019060: Inhibition of Src kinase activity by 7-ethynyl-4-phenylamino-3-quinolinecarbonitriles: identification of SKS-927.

description: Small molecule binding data for protein AKT/p21CIP1, Cyclin-dependent kinase 4, Epidermal growth factor receptor, Pyruvate dehydrogenase kinase isoenzyme 1 (PDK1), Tyrosine-protein kinase SRC, VEGF-receptor 2 and tyrosine-protein kinase SRC, and Vascular endothelial growth factor receptor 2, Uniprot P00533, P11802, P12931, P31749, P35968, Q15118, and Q9WUD9
DOI: 10.7270/q2sx6czf
title: BindingDB Entry 50021883: Structure and property based design of factor Xa inhibitors: pyrrolidin-2-ones with biaryl P4 motifs.

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Uniprot P00742
DOI: 10.7270/q2th8mhf
title: BindingDB Entry 50026797: Aminomethylpiperazines as selective urotensin antagonists.

description: Small molecule binding data for protein Kappa-type opioid receptor, Uniprot P41145
DOI: 10.7270/q2tm79pm
title: BindingDB Entry 50017013: New bicyclic cannabinoid receptor-1 (CB1-R) antagonists.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot P21554 and P34972
DOI: 10.7270/q2wq03hw
title: BindingDB Entry 50021913: Optimization of the heterocyclic core of the quinazolinone-derived CXCR3 antagonists.

description: Small molecule binding data for protein chemokine (C-X-C motif) receptor 3, Uniprot P49682
DOI: 10.7270/q2x929xp
title: BindingDB Entry 50019057: Carinatumins A-C, new alkaloids from Lycopodium carinatum inhibiting acetylcholinesterase.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot P23795
DOI: 10.7270/q2z89c75
title: BindingDB Entry 50026793: Overcoming undesirable CYP1A2 inhibition of pyridylnaphthalene-type aldosterone synthase inhibitors: influence of heteroaryl derivatization on potency and selectivity.

description: Small molecule binding data for protein Aromatase (CYP19), Cytochrome P450 11B2, Cytochrome P450 17A1, Cytochrome P450 1A, Cytochrome P450 2B6, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Steroid 11-beta-Hydroxylase (CYP11B1), Uniprot P05093, P05177, P08684, P10635, P11511, P11712, P15538, P19099, P20813, and P33261
DOI: 10.7270/q2zc82db
title: BindingDB Entry 50017012: Synthesis and pharmacological evaluation of second-generation phosphatidic acid derivatives as lysophosphatidic acid receptor ligands.

description: Small molecule binding data for protein Autotaxin, Lysophosphatidic acid receptor 1 (LPAR1), Lysophosphatidic acid receptor 3 (LPAR3), and Lysophosphatidic acid receptor Edg-4, Uniprot Q13822, Q92633, Q9HBW0, and Q9UBY5
DOI: 10.7270/q20g3jwv
title: BindingDB Entry 50021958: New celecoxib derivatives as anti-inflammatory agents.

description: Small molecule binding data for protein Cyclooxygenase and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P35354
DOI: 10.7270/q2125s92
title: BindingDB Entry 50019070: ortho-Substituted azoles as selective and dual inhibitors of VEGF receptors 1 and 2.

description: Small molecule binding data for protein Vascular endothelial growth factor receptor and Vascular endothelial growth factor receptor 2, Uniprot L7RSL3, P17948, and P35968
DOI: 10.7270/q2125shr
title: BindingDB Entry 50026849: Discovery of 1,3-disubstituted-1H-pyrrole derivatives as potent melanin-concentrating hormone receptor 1 (MCH-R1) antagonists.

description: Small molecule binding data for protein Melanin-concentrating hormone receptor and Voltage-gated potassium channel, Uniprot Q12809 and Q99705
DOI: 10.7270/q2154gm1
title: BindingDB Entry 50017041: Novel 1,3-dipropyl-8-(1-heteroarylmethyl-1H-pyrazol-4-yl)-xanthine derivatives as high affinity and selective A2B adenosine receptor antagonists.

description: Small molecule binding data for protein Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A2b, and Adenosine receptor A3, Uniprot P0DMS8, P29274, P29275, and P30542
DOI: 10.7270/q2222tk7
title: BindingDB Entry 50026806: Synthesis, biological evaluation, and molecular modeling studies of methylene imidazole substituted biaryls as inhibitors of human 17alpha-hydroxylase-17,20-lyase (CYP17)--part II: Core rigidification and influence of substituents at the methylene bridge.

description: Small molecule binding data for protein Cytochrome P450 17A1, Uniprot P05093
DOI: 10.7270/q2251hrd
title: BindingDB Entry 50017023: Tethering identifies fragment that yields potent inhibitors of human caspase-1.

description: Small molecule binding data for protein Caspase-1, Uniprot P29466
DOI: 10.7270/q2445m7q
title: BindingDB Entry 50021957: Synthesis, conformational analysis, and biological evaluation of 1-hexylindolactam-V10 as a selective activator for novel protein kinase C isozymes.

description: Small molecule binding data for protein PKC alpha and beta-2, Protein kinase C alpha type, Protein kinase C delta type, Protein kinase C theta type, Protein kinase C, epsilon, Protein kinase C, eta, and Protein kinase C, gamma, Uniprot P05129, P05771, P17252, P24723, Q02156, Q04759, and Q05655
DOI: 10.7270/q24t6j75
title: BindingDB Entry 50026848: Structure-activity relationship studies on a series of piperazinebenzylalcohols and their ketone and amine analogs as melanocortin-4 receptor ligands.

description: Small molecule binding data for protein Melanocortin receptor 3 (MC3R), Melanocortin receptor 4, and Melanocortin receptor 5 (MC5R), Uniprot P32245, P33032, and P41968
DOI: 10.7270/q24x57bf
title: BindingDB Entry 50017037: Synthesis and biological activity of the first cyclic biphalin analogues.

description: Small molecule binding data for protein Delta-type opioid receptor, Mu-type opioid receptor, Nociceptin/mu opioid receptor, and mu/kappa opioid receptor, Uniprot P32300, P33535, P35372, P41143, and P97266
DOI: 10.7270/q270815g
title: BindingDB Entry 50022021: Prodrug thiamine analogs as inhibitors of the enzyme transketolase.

description: Small molecule binding data for protein Transketolase, Uniprot P29401 and V9HWD9
DOI: 10.7270/q27m07kh
title: BindingDB Entry 50019089: Discovery of 2-iminobenzimidazoles as a new class of trypanothione reductase inhibitor by high-throughput screening.

description: Small molecule binding data for protein Glutathione reductase (GR), Uniprot P00390
DOI: 10.7270/q27w6bx8
title: BindingDB Entry 50021948: Inhibition of dipeptidyl peptidase-IV (DPP-IV) by atorvastatin.

description: Small molecule binding data for protein Dipeptidyl peptidase 4 (DPP4) and Dipeptidyl peptidase IV, Uniprot P22411 and P27487
DOI: 10.7270/q28k78rs
title: BindingDB Entry 50019067: Thienopyridine urea inhibitors of KDR kinase.

description: Small molecule binding data for protein Cytochrome P450 3A and Vascular endothelial growth factor receptor 2, Uniprot P08684 and P35968
DOI: 10.7270/q28k78x1
title: BindingDB Entry 50026846: Bioactive 5alpha-pregnane-type steroidal alkaloids from Sarcococca hookeriana.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot P06276 and P22303
DOI: 10.7270/q28p6025
title: BindingDB Entry 50017033: Substituted indanylacetic acids as PPAR-alpha-gamma activators.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor and Peroxisome proliferator-activated receptor alpha (PPAR alpha), Uniprot P37231 and Q07869
DOI: 10.7270/q2cc10bp
title: BindingDB Entry 50019083: Synthesis and biological evaluation of thiazolidine-2-one 1,1-dioxide as inhibitors of Escherichia coli beta-ketoacyl-ACP-synthase III (FabH).

description: Small molecule binding data for protein Beta-ketoacyl-ACP synthase III (FabH), Uniprot C3TDZ2
DOI: 10.7270/q2cn73mj
title: BindingDB Entry 50021947: Conversion of an MMP-potent scaffold to an MMP-selective HER-2 sheddase inhibitor via scaffold hybridization and subtle P1' permutations.

description: Small molecule binding data for protein Collagenase, Disintegrin and metalloproteinase domain-containing protein 10 (ADAM10), Matrix metalloproteinase-1 (MMP1), and Stromelysin-1, Uniprot O14672, P03956, P08253, P08254, and P14780
DOI: 10.7270/q2db81hz
title: BindingDB Entry 50019065: 1,5-Benzodioxepin derivatives as a novel class of muscarinic M3 receptor antagonists.

description: Small molecule binding data for protein Muscarinic acetylcholine receptor, Muscarinic acetylcholine receptor M1, and Muscarinic acetylcholine receptor M2, Uniprot P08172, P11229, and P20309
DOI: 10.7270/q2db81nr
title: BindingDB Entry 50026838: Further studies on lead compounds containing the opioid pharmacophore Dmt-Tic.

description: Small molecule binding data for protein Delta-type opioid receptor, Mu-opioid receptor, Nociceptin/mu opioid receptor, and Opioid receptors; mu & delta, Uniprot P32300, P33533, and P33535
DOI: 10.7270/q2df6qs3
title: BindingDB Entry 50017031: Design and synthesis of substituted phenylpropanoic acid derivatives as human peroxisome proliferator-activated receptor alpha/delta dual agonists.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor alpha (PPAR alpha), Peroxisome proliferator-activated receptor delta, and Peroxisome proliferator-activated receptor delta (PPAR delta), Uniprot P23204, P35396, P37231, Q03181, and Q07869
DOI: 10.7270/q2h41r3g
title: BindingDB Entry 50019081: Rational design, synthesis, and structure-activity relationship of benzoxazolones: new potent mglu5 receptor antagonists based on the fenobam structure.

description: Small molecule binding data for protein Metabotropic glutamate receptor 5, Uniprot P41594
DOI: 10.7270/q2j10305
title: BindingDB Entry 50026821: 8-Biarylchromen-4-one inhibitors of the DNA-dependent protein kinase (DNA-PK).

description: Small molecule binding data for protein DNA-dependent protein kinase, Uniprot P78527
DOI: 10.7270/q2j67ght
title: BindingDB Entry 50017030: Pyrrolopyridazine MEK inhibitors.

description: Small molecule binding data for protein Dual specificity mitogen-activated protein kinase kinase 1, Uniprot Q02750
DOI: 10.7270/q2m61k0p
title: BindingDB Entry 50021984: Synthesis and structure-activity relationship studies of tyrosine-based antagonists at the human P2X7 receptor.

description: Small molecule binding data for protein P2X purinoceptor 7, Uniprot Q99572
DOI: 10.7270/q2mw2gs1
title: BindingDB Entry 50019080: 3-Substituted-(5-arylfuran-2-ylcarbonyl)guanidines as NHE-1 inhibitors.

description: Small molecule binding data for protein Sodium/hydrogen exchanger 1, Uniprot P19634
DOI: 10.7270/q2n58m32
title: BindingDB Entry 50021939: Synthesis and evaluation in monkey of two sensitive 11C-labeled aryloxyanilide ligands for imaging brain peripheral benzodiazepine receptors in vivo.

description: Small molecule binding data for protein GABA A receptor alpha-6/beta-2/gamma-2, GABA receptor alpha-1/beta-1/gamma-2 subunit, Kappa-type opioid receptor, Peripheral-Type Benzodiazepine Receptor, and Translocator protein, Uniprot P14867, P16257, P18505, P18507, P30536, P41145, P47870, and Q16445
DOI: 10.7270/q2ns0tpb
title: BindingDB Entry 50026818: A novel 5-[1,3,4-oxadiazol-2-yl]-N-aryl-4,6-pyrimidine diamine having dual EGFR/HER2 kinase activity: design, synthesis, and biological activity.

description: Small molecule binding data for protein Cyclin-dependent kinase 1, Epidermal growth factor receptor, Epidermal growth factor receptor and ErbB2 (HER1 and HER2), Serine/threonine-protein kinase Aurora, and Vascular endothelial growth factor receptor 2, Uniprot O14965, P00533, P04626, P06493, and P35968
DOI: 10.7270/q2nz876s
title: BindingDB Entry 50017029: 5-heteroatom substituted pyrazoles as canine COX-2 inhibitors. Part 1: Structure-activity relationship studies of 5-alkylamino pyrazoles and discovery of a potent, selective, and orally active analog.

description: Small molecule binding data for protein Cyclooxygenase, Cyclooxygenase-1, and Cyclooxygenase-2, Uniprot P35354 and Q8HZR1
DOI: 10.7270/q2qz29qp
title: BindingDB Entry 50021968: Conformationally constrained diketopimelic acid analogues as inhibitors of dihydrodipicolinate synthase.

description: Small molecule binding data for protein Dihydrodipicolinate synthase-like, mitochondrial, Uniprot Q86XE5
DOI: 10.7270/q2rj4j5b
title: BindingDB Entry 50019079: 3-Mercaptopropionic acids as efficacious inhibitors of activated thrombin activatable fibrinolysis inhibitor (TAFIa).

description: Small molecule binding data for protein Carboxypeptidase B, Carboxypeptidase N, catalytic subunit, and Thrombin-activable fibrinolysis inhibitor (TAFIa), Uniprot P09955, P15169, and Q96IY4
DOI: 10.7270/q2sj1kd2
title: BindingDB Entry 50026811: Discovery of imidazole vinyl pyrimidines as a novel class of kinase inhibitors which inhibit Tie-2 and are orally bioavailable.

description: Small molecule binding data for protein Vascular endothelial growth factor receptor, Vascular endothelial growth factor receptor 2, and Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2), Uniprot L7RSL3, P17948, P35968, and Q02763
DOI: 10.7270/q2sq8zxq
title: BindingDB Entry 50017028: Design, synthesis, and vasorelaxant and platelet antiaggregatory activities of coumarin-resveratrol hybrids.

description: Small molecule binding data for protein Alpha-1D adrenergic receptor and Cyclooxygenase-1 (COX-1), Uniprot P23219 and P23944
DOI: 10.7270/q2vq32fd
title: BindingDB Entry 50021959: Further structure-activity relationships study of hybrid 7-{[2-(4-phenylpiperazin-1-yl)ethyl]propylamino}-5,6,7,8-tetrahydronaphthalen-2-ol analogues: identification of a high-affinity D3-preferring agonist with potent in vivo activity with long duration of action.

description: Small molecule binding data for protein Dopamine receptor and Dopamine receptor D2L/neurotensin receptor NTS1, Uniprot P14416 and P35462
DOI: 10.7270/q2w958v6
title: BindingDB Entry 50019072: Endomorphin-1 analogs with enhanced metabolic stability and systemic analgesic activity: design, synthesis, and pharmacological characterization.

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, and P97266
DOI: 10.7270/q2x92b3b
title: BindingDB Entry 50026808: Stereoselective synthesis and biological evaluation of 3,4-diaminocyclohexanecarboxylic acid derivatives as factor Xa inhibitors.

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Uniprot P00742
DOI: 10.7270/q2xd118h
title: BindingDB Entry 50017027: A new chemical tool for exploring the physiological function of the PDE2 isozyme.

description: Small molecule binding data for protein Phosphodiesterase 1, Phosphodiesterase 11A (PDE11A), Phosphodiesterase 3, Phosphodiesterase 8, Phosphodiesterase 9A, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, cAMP-specific 3',5'-cyclic phosphodiesterase 4A, cAMP-specific 3',5'-cyclic phosphodiesterase 4B, cAMP-specific 3',5'-cyclic phosphodiesterase 4C, cAMP-specific 3',5'-cyclic phosphodiesterase 4D, cGMP-dependent 3',5'-cyclic phosphodiesterase, and cGMP-specific 3',5'-cyclic phosphodiesterase, Uniprot O00408, O60658, O76074, O76083, O95263, P27815, P54750, Q01064, Q07343, Q08493, Q08499, Q13370, Q14123, Q14432, Q9HCR9, and Q9Y233
DOI: 10.7270/q2028r64
title: BindingDB Entry 50019093: Synthesis, cytotoxicity, and DNA topoisomerase II inhibitory activity of benzofuroquinolinediones.

description: Small molecule binding data for protein DNA topoisomerase I (Topo I), Uniprot P11387
DOI: 10.7270/q2028rcc
title: BindingDB Entry 50026882: Pyridyl and thiazolyl bisamide CSF-1R inhibitors for the treatment of cancer.

description: Small molecule binding data for protein Macrophage colony stimulating factor receptor, Uniprot P07333
DOI: 10.7270/q22807ct
title: BindingDB Entry 50022081: Acylguanidine inhibitors of beta-secretase: optimization of the pyrrole ring substituents extending into the S1 and S3 substrate binding pockets.

description: Small molecule binding data for protein Beta-secretase 1, Beta-secretase 2 (BACE2), and Cathepsin D, Uniprot P07339, P56817, and Q9Y5Z0
DOI: 10.7270/q23778g6
title: BindingDB Entry 50022025: Synthesis and in vivo evaluation of halogenated N,N-dimethyl-2-(2'-amino-4'-hydroxymethylphenylthio)benzylamine derivatives as PET serotonin transporter ligands.

description: Small molecule binding data for protein Serotonin and norepinephrine transporters (SERT/NET), Sodium-dependent dopamine transporter, and Sodium-dependent noradrenaline transporter, Uniprot P23975, P31645, and Q01959
DOI: 10.7270/q23t9gv7
title: BindingDB Entry 50019091: 3-[2-((2S)-2-cyano-pyrrolidin-1-yl)-2-oxo-ethylamino]-3-methyl-butyramide analogues as selective DPP-IV inhibitors for the treatment of type-II diabetes.

description: Small molecule binding data for protein Dipeptidyl peptidase 2 (DPP II), Dipeptidyl peptidase 4 (DPP4), Dipeptidyl peptidase VIII, and Fibroblast activation protein alpha, Uniprot P27487, Q12884, Q6V1X1, and Q9UHL4
DOI: 10.7270/q23t9h2b
title: BindingDB Entry 50026873: Thiadiazolopiperazinyl ureas as inhibitors of fatty acid amide hydrolase.

description: Small molecule binding data for protein Anandamide amidohydrolase and Fatty-acid amide hydrolase 1 (FAAH), Uniprot O00519 and P97612
DOI: 10.7270/q26m36gk
title: BindingDB Entry 50019126: New beta-alanine derivatives are orally available glucagon receptor antagonists.

description: Small molecule binding data for protein Glucagon receptor and Glucagon-like peptide 1 receptor (GLP-1), Uniprot P30082, P43220, and P47871
DOI: 10.7270/q27m07s6
title: BindingDB Entry 50026869: Thiazolidinone CFTR inhibitors with improved water solubility identified by structure-activity analysis.

description: Small molecule binding data for protein CFTR, Uniprot P13569
DOI: 10.7270/q27p8xx0
title: BindingDB Entry 50017064: Structure-activity relationship of triazafluorenone derivatives as potent and selective mGluR1 antagonists.

description: Small molecule binding data for protein Metabotropic glutamate receptor, Metabotropic glutamate receptor 1, Metabotropic glutamate receptor 5, and metabotropic glutamate 1/2, Uniprot P23385, P31424, P41594, and Q13255
DOI: 10.7270/q2bc3z6x
title: BindingDB Entry 50019123: 2-(4-Chlorobenzyl)-3-hydroxy-7,8,9,10-tetrahydrobenzo[H]quinoline-4-carboxylic acid (PSI-697): identification of a clinical candidate from the quinoline salicylic acid series of P-selectin antagonists.

description: Small molecule binding data for protein P-selectin/P-selectin glycoprotein ligand 1, Uniprot P16109
DOI: 10.7270/q2bp02jm
title: BindingDB Entry 50022018: beta-N-Biaryl ether sulfonamide hydroxamates as potent gelatinase inhibitors: part 2. Optimization of alpha-amino substituents.

description: Small molecule binding data for protein Collagenase, Matrix metalloproteinase-1 (MMP1), and Stromelysin-1, Uniprot P03956, P08253, P08254, P14780, and P45452
DOI: 10.7270/q2cc10hx
title: BindingDB Entry 50026868: Discovery of betamethasone 17alpha-carbamates as dissociated glucocorticoid receptor modulators in the rat.

description: Small molecule binding data for protein Glucocorticoid receptor, Matrix metalloproteinase-1 (MMP1), Progesterone receptor, and Tyrosine aminotransferase, Uniprot P03956, P04150, P04694, and P06401
DOI: 10.7270/q2cf9pnq
title: BindingDB Entry 50017062: Tricyclic pyrazoles. 3. Synthesis, biological evaluation, and molecular modeling of analogues of the cannabinoid antagonist 8-chloro-1-(2',4'-dichlorophenyl)-N-piperidin-1-yl-1,4,5,6-tetrahydrobenzo[6,7]cyclohepta[1,2-c]pyrazole-3-carboxamide.

description: Small molecule binding data for protein Cannabinoid receptor and Cannabinoid receptor 1 (CB1R), Uniprot P47746 and P47936
DOI: 10.7270/q2ff3s4k
title: BindingDB Entry 50022069: From rigid cyclic templates to conformationally stabilized acyclic scaffolds. Part II: Acyclic replacements for the (3S)-3-benzylpiperidine in a series of potent CCR3 antagonists.

description: Small molecule binding data for protein C-C chemokine receptor type 3, Uniprot P51677
DOI: 10.7270/q2g44pzp
title: BindingDB Entry 50019119: 4-amino-5-aryl-6-arylethynylpyrimidines: structure-activity relationships of non-nucleoside adenosine kinase inhibitors.

description: Small molecule binding data for protein Adenosine kinase, Uniprot P55263
DOI: 10.7270/q2gf0t7h
title: BindingDB Entry 50021997: Syntheses of tetrahydrothiophenes and tetrahydrofurans and studies of their derivatives as melanocortin-4 receptor ligands.

description: Small molecule binding data for protein Melanocortin receptor 4, Uniprot P32245