cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2r2128x
title: BindingDB Entry 50038510: Selective androgen receptor modulators based on a series of 7H-[1,4]oxazino[3,2-g]quinolin-7-ones with improved in vivo activity.

description: Small molecule binding data for protein Androgen Receptor, Uniprot P10275
DOI: 10.7270/q2rf5vtx
title: BindingDB Entry 50037629: 2-(Benzimidazol-2-yl)quinoxalines: a novel class of selective antagonists at human A(1) and A(3) adenosine receptors designed by 3D database searching.

description: Small molecule binding data for protein Adenosine receptor A1, Adenosine receptor A2a, and Adenosine receptor A3, Uniprot P0DMS8, P29274, and P30542
DOI: 10.7270/q2sf2wpq
title: BindingDB Entry 50034984: Synthesis and biological activity of 3-substituted 3-desoxynaltrindole derivatives.

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/q2st7qdr
title: BindingDB Entry 50035827: [D-Pen2,D-Pen5]enkephalin analogues with increased affinity and selectivity for delta opioid receptors.

description: Small molecule binding data for protein Nociceptin/mu opioid receptor and Opioid receptors; mu & delta, Uniprot P33533 and P33535
DOI: 10.7270/q2tm7bsc
title: BindingDB Entry 50036715: Human P2Y1 receptor: molecular modeling and site-directed mutagenesis as tools to identify agonist and antagonist recognition sites.

description: Small molecule binding data for protein Purinergic receptor P2Y1, Uniprot P47900
DOI: 10.7270/q2tt4rv5
title: BindingDB Entry 50038517: Identification of acridinyl hydrazides as potent aspartic protease inhibitors.

description: Small molecule binding data for protein Cathepsin D and Plasmepsin 2, Uniprot P07339 and P46925
DOI: 10.7270/q2vq33km
title: BindingDB Entry 50038509: Novel 2-imidazoles as potent and selective alpha1A adrenoceptor partial agonists.

description: Small molecule binding data for protein Adrenergic alpha1B, Alpha-1A adrenergic receptor, Alpha-1D adrenergic receptor, and Alpha-2A adrenergic receptor, Uniprot P08913, P25100, P35348, and P35368
DOI: 10.7270/q2w66mjn
title: BindingDB Entry 50037628: Synthesis and antibacterial activity of 3-substituted-6-(3-ethyl-4-methylanilino)uracils.

description: Small molecule binding data for protein DNA polymerase IIIC, Uniprot P13267
DOI: 10.7270/q2x63ngb
title: BindingDB Entry 50034983: Diimidazo[1,2-c:4',5'-e]pyrimidines: N6-N1 conformationally restricted adenosines.

description: Small molecule binding data for protein Adenosine Receptors A2a (A2a) and Adenosine receptor A1, Uniprot P25099 and P30543
DOI: 10.7270/q2xg9rr6
title: BindingDB Entry 50035825: Inhibitors of cholesterol biosynthesis. 1. trans-6-(2-pyrrol-1-ylethyl)-4-hydroxypyran-2-ones, a novel series of HMG-CoA reductase inhibitors. 1. Effects of structural modifications at the 2- and 5-positions of the pyrrole nucleus.

description: Small molecule binding data for protein HMG-CoA reductase, Uniprot P51639
DOI: 10.7270/q2zc83jj
title: BindingDB Entry 50036714: Rational drug design approach for overcoming drug resistance: application to pyrimethamine resistance in malaria.

description: Small molecule binding data for protein Dihydrofolate Reductase-Thymidylate Synthase (DHFR-TS) Mutant KICB1, Uniprot P13922
DOI: 10.7270/q2zg6stp
title: BindingDB Entry 50035817: Alterations in the stereochemistry of the kappa-selective opioid agonist U50,488 result in high-affinity sigma ligands.

description: Small molecule binding data for protein Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor, Sigma, and mu/kappa opioid receptor, Uniprot P41144, P61169, and Q99720
DOI: 10.7270/q2zg6t44
title: BindingDB Entry 50038516: Pyridyl-phenyl ether monoamine reuptake inhibitors: Impact of lipophilicity on dual SNRI pharmacology and off-target promiscuity.

description: Small molecule binding data for protein Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Serotonin and norepinephrine transporters (SERT/NET), Sodium-dependent dopamine transporter, and Sodium-dependent noradrenaline transporter, Uniprot P08684, P10635, P23975, P31645, and Q01959
DOI: 10.7270/q20002vn
title: BindingDB Entry 50037635: Carbonic anhydrase inhibitors: inhibition of the human isozymes I, II, VA, and IX with a library of substituted difluoromethanesulfonamides.

description: Small molecule binding data for protein Carbonic Anhydrase VA, Carbonic anhydrase, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot P00915, P00918, P35218, and Q16790
DOI: 10.7270/q20c4wcm
title: BindingDB Entry 50035841: 2-Phenyl-2-(1-hydroxycycloalkyl)ethylamine derivatives: synthesis and antidepressant activity.

description: Small molecule binding data for protein Alpha-1A adrenergic receptor, Norepinephrine Monoamine transporters, and Sodium-dependent serotonin transporter, Uniprot P31652 and P43140
DOI: 10.7270/q20z73sg
title: BindingDB Entry 50034990: Azaindole derivatives with high affinity for the dopamine D4 receptor: synthesis, ligand binding studies and comparison of molecular electrostatic potential maps.

description: Small molecule binding data for protein DRD1, DRD2, Dopamine receptor, and Dopamine receptors; D2 & D4, Uniprot P20288, P21917, P35462, and Q95136
DOI: 10.7270/q2183732
title: BindingDB Entry 50035833: Synthesis and structural requirements of N-substituted norapomorphines for affinity and activity at dopamine D-1, D-2, and agonist receptor sites in rat brain.

description: Small molecule binding data for protein DOPAMINE and Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor, Uniprot P18901 and P61169
DOI: 10.7270/q22808h1
title: BindingDB Entry 50038523: New tetrazole-based selective anandamide uptake inhibitors.

description: Small molecule binding data for protein Anandamide amidohydrolase, Cannabinoid receptor 1, Cannabinoid receptor 2, Sn1-specific diacylglycerol lipase alpha, Transient receptor potential cation channel subfamily A member 1, and Transient receptor potential cation channel subfamily V member 1, Uniprot P21554, P34972, P97612, Q6RI86, Q8NER1, and Q9Y4D2
DOI: 10.7270/q23n2466
title: BindingDB Entry 50037634: Novel cell-penetrating alpha-keto-amide calpain inhibitors as potential treatment for muscular dystrophy.

description: Small molecule binding data for protein Cathepsin (B and K), Uniprot P07858
DOI: 10.7270/q24q7vht
title: BindingDB Entry 50034989: 2,6,9-trisubstituted purines: optimization towards highly potent and selective CDK1 inhibitors.

description: Small molecule binding data for protein Cyclin-dependent kinase 1/G1/S-specific cyclin-D1, MER intracellular domain/EGFR extracellular domain chimera, Protein kinase C alpha type, and cAMP-dependent protein kinase (PKA), Uniprot P00533, P06493, P17252, P17612, P22612, and P22694
DOI: 10.7270/q2611169
title: BindingDB Entry 50038522: Structure-activity relationships of anthranilamide-based factor Xa inhibitors containing piperidinone and pyridinone P4 moieties.

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Uniprot P00742
DOI: 10.7270/q27d2vx4
title: BindingDB Entry 50037633: Nonsteroidal anti-inflammatory drugs and their analogues as inhibitors of aldo-keto reductase AKR1C3: new lead compounds for the development of anticancer agents.

description: Small molecule binding data for protein 17-beta-Hydroxysteroid Dehydrogenase 5 (17-beta-HSD5, AKR1C3), Uniprot P42330
DOI: 10.7270/q28g8m7j
title: BindingDB Entry 50034988: A study of novel antiallergic agents with eosinophilic infiltration inhibiting action.

description: Small molecule binding data for protein 5-lipoxygenase/FLAP, Uniprot P09917
DOI: 10.7270/q28p616c
title: BindingDB Entry 50036733: Design and synthesis of isoxazoline derivatives as factor Xa inhibitors. 1.

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Prothrombin, and Trypsin-1, Uniprot P00734, P00742, and P07477
DOI: 10.7270/q28s4qhz
title: BindingDB Entry 50035831: 4-(1,2,5,6-Tetrahydro-1-alkyl-3-pyridinyl)-2-thiazolamines: a novel class of compounds with central dopamine agonist properties.

description: Small molecule binding data for protein DOPAMINE and Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor, Uniprot P18901 and P61169
DOI: 10.7270/q29s1rxx
title: BindingDB Entry 50038521: 2-Aminomethyl piperidines as novel urotensin-II receptor antagonists.

description: Small molecule binding data for protein Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Urotensin II receptor, Uniprot P08684, P10635, and Q9UKP6
DOI: 10.7270/q2c53mmd
title: BindingDB Entry 50037632: Novel CCR1 antagonists with oral activity in the mouse collagen induced arthritis.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 2C (5-HT2C), 5-Hydroxytryptamine receptor 6 (5-HT6), 5-Hydroxytryptamine receptor 7 (5-HT7), 5-hydroxytryptamine receptor 1A, 5-hydroxytryptamine receptor 1B, Alpha-2A adrenergic receptor, Alpha-2B adrenergic receptor, Alpha-2C adrenergic receptor, Beta-1 adrenergic receptor, Beta-2 adrenergic receptor and beta-3 adrenergic receptor, C-C chemokine receptor type 1, C-C chemokine receptor type 2, C-C chemokine receptor type 3, C-C chemokine receptor type 5, C-C chemokine receptor type 6 (CCR6), Delta-type opioid receptor, Dopamine D1 and D2 receptor, Dopamine receptor, Dopamine receptor D2L/neurotensin receptor NTS1, Dopamine receptors; D2 & D4, Kappa-type opioid receptor, Mu-type opioid receptor, Muscarinic acetylcholine receptor, Muscarinic acetylcholine receptor M1, Muscarinic acetylcholine receptor M1/M5 chimeric protein, Muscarinic acetylcholine receptor M2, Muscarinic acetylcholine receptor M2 and M4, Serotonin 3a (5-HT3a)/3b (5-HT3b)/3c (5-HT3c)/3d (5-HT3d)/3e (5-HT3e) receptor, and Serotonin receptor (2b and 2c), Uniprot A5X5Y0, O95264, O95950, P07550, P08172, P08173, P08588, P08908, P08912, P08913, P11229, P14416, P18089, P18825, P20309, P21728, P21917, P28222, P28223, P28335, P32246, P34969, P35372, P35462, P41143, P41145, P41595, P41597, P46098, P50406, P51675, P51677, P51682, P51684, Q4W594, Q70Z44, and Q8WXA8
DOI: 10.7270/q2cj8f2v
title: BindingDB Entry 50035838: An initial three-component pharmacophore for specific serotonin-3 receptor ligands.

description: Small molecule binding data for protein Serotonin 3 (5-HT3) receptor and Serotonin 3 receptor (5HT3), Uniprot P46098 and Q9JHJ5
DOI: 10.7270/q2df6rx9
title: BindingDB Entry 50036731: 2,7-Disubstituted amidofluorenone derivatives as inhibitors of human telomerase.

description: Small molecule binding data for protein Telomerase reverse transcriptase, Uniprot O14746
DOI: 10.7270/q2dj5g7p
title: BindingDB Entry 50035830: Highly selective kappa-opioid analgesics. 3. Synthesis and structure-activity relationships of novel N-[2-(1-pyrrolidinyl)-4- or -5-substituted-cyclohexyl]arylacetamide derivatives.

description: Small molecule binding data for protein mu/kappa opioid receptor, Uniprot P41144
DOI: 10.7270/q2fj2hp3
title: BindingDB Entry 50038520: Orally efficacious thrombin inhibitors with cyanofluorophenylacetamide as the P2 motif.

description: Small molecule binding data for protein Prothrombin, Uniprot P00734
DOI: 10.7270/q2fx7b6f
title: BindingDB Entry 50037639: Sulfonamide chalcone as a new class of alpha-glucosidase inhibitors.

description: Small molecule binding data for protein Alpha-amylase and Beta-amylase, Uniprot P06278 and P16098
DOI: 10.7270/q2gx4cbt
title: BindingDB Entry 50037631: Grafting aminocyclopentane carboxylic acids onto the RGD tripeptide sequence generates low nanomolar alphaVbeta3/alphaVbeta5 integrin dual binders.

description: Small molecule binding data for protein Integrin beta-3/Vitronectin receptor alpha and Integrin beta-5/Vitronectin receptor alpha, Uniprot P05106, P06756, and P18084
DOI: 10.7270/q2h132jr
title: BindingDB Entry 50034994: Design of the first highly potent and selective aminopeptidase N (EC 3.4.11.2) inhibitor.

description: Small molecule binding data for protein Aminopeptidase A, Aminopeptidase B, and Aminopeptidase N, Uniprot P15145, Q8VCT3, and Q95334
DOI: 10.7270/q2h995s5
title: BindingDB Entry 50035837: Thiazole as a carbonyl bioisostere. A novel class of highly potent and selective 5-HT3 receptor antagonists.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A (5HT1A), 5-hydroxytryptamine receptor 1B, 5-hydroxytryptamine receptor 1D, Adenosine receptor A2b, Adrenergic receptor alpha, Beta-2 adrenergic receptor, Dopamine D1 receptor, Dopamine receptor D2L/neurotensin receptor NTS1, Mu-type opioid receptor, Muscarinic receptor M2 and M3, Serotonin 2a (5-HT2a) receptor, Serotonin 3 (5-HT3) receptor, Serotonin receptor 2a and 2c (5HT2A and 5HT2C), and Sigma, Uniprot P08483, P08909, P14416, P22909, P28221, P28222, P29276, P35372, P46098, P54833, Q61616, Q64264, Q75Z89, and Q99720
DOI: 10.7270/q2j67hmk
title: BindingDB Entry 50036730: Carbonic anhydrase inhibitors. Synthesis of water-soluble, topically effective, intraocular pressure-lowering aromatic/heterocyclic sulfonamides containing cationic or anionic moieties: is the tail more important than the ring?

description: Small molecule binding data for protein Carbonic Anhydrase IV, Carbonic anhydrase, and Carbonic anhydrase 2, Uniprot P00915, P00918, and Q95323
DOI: 10.7270/q2kp82xr
title: BindingDB Entry 50037638: N-8-Substituted benztropinamine analogs as selective dopamine transporter ligands.

description: Small molecule binding data for protein Dopamine Transporter (DAT), Muscarinic acetylcholine receptor M1, Serotonin and norepinephrine transporters (SERT/NET), and Sodium-dependent noradrenaline transporter, Uniprot P11229, P23975, P23977, and P31645
DOI: 10.7270/q2ms3t8s
title: BindingDB Entry 50034993: Metallopeptide approach to the design of biologically active ligands: design of specific human neutrophil elastase inhibitors.

description: Small molecule binding data for protein Leukocyte elastase and Pancreatic elastase, Uniprot P08246 and P08419
DOI: 10.7270/q2n29xjz
title: BindingDB Entry 50035836: Orally potent human renin inhibitors derived from angiotensinogen transition state: design, synthesis, and mode of interaction.

description: Small molecule binding data for protein Angiotensin-converting enzyme, Cathepsin D, Chymotrypsin, Pepsin A, and Renin, Uniprot P00791, P00797, P12822, P80209, and Q99895
DOI: 10.7270/q2np24zc
title: BindingDB Entry 50034985: Sulfonamide-based hydroxamic acids as potent inhibitors of mouse macrophage metalloelastase.

description: Small molecule binding data for protein Matrix metalloproteinase 12, Uniprot P34960
DOI: 10.7270/q2nv9jx8
title: BindingDB Entry 50036729: alpha-Functionalized phosphonylphosphinates: synthesis and evaluation as transcarbamoylase inhibitors.

description: Small molecule binding data for protein Ornithine carbamoyltransferase, Uniprot P00480
DOI: 10.7270/q2p2701m
title: BindingDB Entry 50038526: Sulfamoyl benzamides as novel CB2 cannabinoid receptor ligands.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot P21554 and P34972
DOI: 10.7270/q2q24150
title: BindingDB Entry 50038518: Discovery of trypanocidal thiosemicarbazone inhibitors of rhodesain and TbcatB.

description: Small molecule binding data for protein Cathepsin (B and K) and Cathepsin L1, Uniprot P07711 and P07858
DOI: 10.7270/q2qf8tn3
title: BindingDB Entry 50037637: Discovery and development of a new class of potent, selective, orally active oxytocin receptor antagonists.

description: Small molecule binding data for protein Cytochrome P450 2C19, Cytochrome P450 2C9, Oxytocin receptor, Vasopressin V1a receptor (V1a), Vasopressin V1b receptor, and Vasopressin V2 receptor (V2), Uniprot P11712, P30518, P30559, P33261, P37288, P47901, and P70536
DOI: 10.7270/q2rf5vjb
title: BindingDB Entry 50034992: Adenosine-5'-carboxylic acid peptidyl derivatives as inhibitors of protein kinases.

description: Small molecule binding data for protein CaM kinase I alpha and PKC alpha and beta-2, Uniprot P05771
DOI: 10.7270/q2rv0p9c
title: BindingDB Entry 50035835: GABA agonists and uptake inhibitors. Synthesis, absolute stereochemistry, and enantioselectivity of (R)-(-)- and (S)-(+)-homo-beta-proline.

description: Small molecule binding data for protein GABA-B receptor 1/2, Uniprot O88871 and Q9Z0U4
DOI: 10.7270/q2sn09m3
title: BindingDB Entry 50036728: Potent inhibition of steroid sulfatase activity by 3-O-sulfamate 17alpha-benzyl(or 4'-tert-butylbenzyl)estra-1,3,5(10)-trienes: combination of two substituents at positions C3 and c17alpha of estradiol.

description: Small molecule binding data for protein Steroid Sulfatase (STS), Uniprot P08842
DOI: 10.7270/q2st7qr7
title: BindingDB Entry 50038525: Development of a fluorescence polarization based assay for histone deacetylase ligand discovery.

description: Small molecule binding data for protein Histone deacetylase and Histone deacetylase 3/Nuclear receptor corepressor 2, Uniprot A0A024QZ26, O15379, Q9UBN7, and Q9Y618
DOI: 10.7270/q2v69kct
title: BindingDB Entry 50037636: Synthesis and pharmacology of willardiine derivatives acting as antagonists of kainate receptors.

description: Small molecule binding data for protein Glutamate kainate, Glutamate-Kainate 7, and Ionotropic glutamate receptor kainate 2/5, Uniprot P22756, P42260, and Q13003
DOI: 10.7270/q2w66m82
title: BindingDB Entry 50034991: Efficient inhibition of muscle and liver glycogen phosphorylases by a new glucopyranosylidene-spiro-thiohydantoin.

description: Small molecule binding data for protein Liver glycogen phosphorylase and Muscle glycogen phosphorylase, Uniprot P09811 and P11217
DOI: 10.7270/q2wm1f0n
title: BindingDB Entry 50035834: Estrogen synthetase inhibitors. 2. Comparison of the in vitro aromatase inhibitory activity for a variety of nitrogen heterocycles substituted with diarylmethane or diarylmethanol groups.

description: Small molecule binding data for protein Cytochrome P450 19A1, Uniprot P22443
DOI: 10.7270/q2xd12bt
title: BindingDB Entry 50036725: 1-(1,2,5-Thiadiazol-4-yl)-4-azatricyclo[2.2.1.0(2,6)]heptanes as new potent muscarinic M1 agonists: structure-activity relationship for 3-aryl-2-propyn-1-yloxy and 3-aryl-2-propyn-1-ylthio derivatives.

description: Small molecule binding data for protein Muscarinic acetylcholine receptor M1, Muscarinic acetylcholine receptor M2, and Muscarinic receptor M2 and M3, Uniprot P08172, P10980, and P11229
DOI: 10.7270/q2xk8gfh
title: BindingDB Entry 50038524: Design of (N)-methanocarba adenosine 5'-uronamides as species-independent A3 receptor-selective agonists.

description: Small molecule binding data for protein Adenosine A1 receptor, Adenosine A2a receptor, Adenosine A3 receptor, Adenosine Receptors A2a (A2a), Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A2a and A3, and Adenosine receptor A3, Uniprot P0DMS8, P25099, P28647, P29274, P30542, P30543, Q60612, Q60613, and Q61618
DOI: 10.7270/q20002k2
title: BindingDB Entry 50034999: Picking the S1, S1' and S2' pockets of matrix metalloproteinases. A niche for potent acyclic sulfonamide inhibitors.

description: Small molecule binding data for protein Collagenase, Matrix metalloproteinase 9, Matrix metalloproteinase-1 (MMP1), Matrix metalloproteinase-2, and Stromelysin-1, Uniprot P03956, P08253, P08254, P14780, P33434, P41245, and P45452
DOI: 10.7270/q2154hqs
title: BindingDB Entry 50036738: Importance of the aromatic residue at position 6 of [Nle(10)]neurokinin A(4-10) for binding to the NK-2 receptor and receptor activation.

description: Small molecule binding data for protein Neurokinin 2 receptor, Uniprot P21452
DOI: 10.7270/q21c1xr4
title: BindingDB Entry 50038531: Reactive derivatives for affinity labeling in the ifenprodil site of NMDA receptors.

description: Small molecule binding data for protein Glutamate [NMDA] receptor subunit epsilon 1/zeta 1, Glutamate [NMDA] receptor subunit epsilon 2/zeta 1, and N-methyl D-aspartate receptor subtype 2B (NMDA)(NR2B), Uniprot Q00960, Q05586, Q12879, and Q13224
DOI: 10.7270/q22r3sf9
title: BindingDB Entry 50037642: Dopamine/serotonin receptor ligands. 10: SAR Studies on azecine-type dopamine receptor ligands by functional screening at human cloned D1, D2L, and D5 receptors with a microplate reader based calcium assay lead to a novel potent D1/D5 selective antagonist.

description: Small molecule binding data for protein Dopamine D1 and D2 receptor, Dopamine D5 receptor, Dopamine receptor, Dopamine receptor D2L/neurotensin receptor NTS1, and Dopamine receptors; D2 & D4, Uniprot P14416, P21728, P21917, P21918, and P35462
DOI: 10.7270/q23r0tc0
title: BindingDB Entry 50034998: Derivation of a possible transition-state for the reaction catalysed by the enzyme estrone Sulfatase (ES).

description: Small molecule binding data for protein Steroid Sulfatase (STS), Uniprot P08842
DOI: 10.7270/q23x879t
title: BindingDB Entry 50036745: A multisubstrate adduct inhibitor of AICAR transformylase.

description: Small molecule binding data for protein AICAR transformylase, Uniprot P31939
DOI: 10.7270/q2416xn5
title: BindingDB Entry 50035840: Synthesis of novel (aryloxy)propanolamines and related compounds possessing both class II and class III antiarrhythmic activity.

description: Small molecule binding data for protein Beta-1 adrenergic receptor and Beta-2 adrenergic receptor, Uniprot P08588 and P54833
DOI: 10.7270/q24x58gn
title: BindingDB Entry 50036736: 2,3-Dihydro-2-oxo-1H-benzimidazole-1-carboxamides with selective affinity for the 5-HT(4) receptor: synthesis and structure-affinity and structure-activity relationships of a new series of partial agonist and antagonist derivatives.

description: Small molecule binding data for protein HTR4 and Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor, Uniprot O70528, P35563, and Q9JJ16
DOI: 10.7270/q251403c
title: BindingDB Entry 50038530: Synthesis and PKCtheta inhibitory activity of a series of 4-(indol-5-ylamino)thieno[2,3-b]pyridine-5-carbonitriles.

description: Small molecule binding data for protein AKT/p21CIP1, Dual specificity mitogen-activated protein kinase kinase 2, PKC alpha and beta-2, Protein kinase C delta type, Protein kinase C theta type, Protein kinase C, epsilon, Protein kinase C, eta, and SRC, Uniprot P05771, P06239, P24723, P31749, P36507, Q02111, Q02156, Q04759, and Q05655
DOI: 10.7270/q26d5tsr
title: BindingDB Entry 50037641: N-[(3S)-1-benzylpyrrolidin-3-yl]-(2-thienyl)benzamides: human dopamine D4 ligands with high affinity for the 5-HT2A receptor.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), Dopamine receptor D2L/neurotensin receptor NTS1, and Dopamine receptors; D2 & D4, Uniprot P14416, P21917, and P28223
DOI: 10.7270/q26t0n7r
title: BindingDB Entry 50035847: Synthesis, biological profile, and quantitative structure-activity relationship of a series of novel 3-hydroxy-3-methylglutaryl coenzyme A reductase inhibitors.

description: Small molecule binding data for protein HMG-CoA reductase, Uniprot P51639
DOI: 10.7270/q27p9020
title: BindingDB Entry 50036744: Design and in vivo analysis of potent non-thiol inhibitors of farnesyl protein transferase.

description: Small molecule binding data for protein Geranylgeranyl Transferase (GGTase-I) and Protein Farnesyltransferase (PFT), Uniprot P29702, P49354, P49356, and Q5EAD5
DOI: 10.7270/q27s7pb4
title: BindingDB Entry 50035839: Pyrroloisoquinoline antidepressants. 3. A focus on serotonin.

description: Small molecule binding data for protein Norepinephrine transporter and SLC6A3, Uniprot O55192 and Q61327
DOI: 10.7270/q28s4qsj
title: BindingDB Entry 50038529: Discovery of a novel submicromolar inhibitor of the lymphoid specific tyrosine phosphatase.

description: Small molecule binding data for protein Tyrosine-protein phosphatase non-receptor type 22, Uniprot Q9Y2R2
DOI: 10.7270/q29887sd
title: BindingDB Entry 50037648: Design, synthesis, and biological evaluation of the N-diarylalkenyl-piperidinecarboxylic acid derivatives as GABA uptake inhibitors (I).

description: Small molecule binding data for protein GABA transporter 1, Uniprot P30531