cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2rf5wjr
title: BindingDB Entry 50043957: Structural modifications of neuroprotective anti-Parkinsonian (-)-N6-(2-(4-(biphenyl-4-yl)piperazin-1-yl)-ethyl)-N6-propyl-4,5,6,7-tetrahydrobenzo[d]thiazole-2,6-diamine (D-264): an effort toward the improvement of in vivo efficacy of the parent molecule.

description: Small molecule binding data for protein Dopamine receptor D2L/neurotensin receptor NTS1, Uniprot P14416
DOI: 10.7270/q2rn399w
title: BindingDB Entry 50043330: Discovery of highly potent and selective D4 ligands by interactive SAR study.

description: Small molecule binding data for protein Dopamine receptor D2L/neurotensin receptor NTS1, Uniprot P14416
DOI: 10.7270/q2rr20xw
title: BindingDB Entry 50045449: Scaffold hopping: exploration of acetanilide-containing uracil analogues as potential NNRTIs.

description: Small molecule binding data for protein Human immunodeficiency virus type 1 reverse transcriptase and Reverse transcriptase, Uniprot Q9WKE8
DOI: 10.7270/q2rv0q8b
title: BindingDB Entry 50044464: Concise synthesis of C-1-cyano-iminosugars via a new Staudinger/aza Wittig/Strecker multicomponent reaction strategy.

description: Small molecule binding data for protein Beta-glucosidase and Glucocerebrosidase (Acid beta-Glucosidase), Uniprot P04062 and P27034
DOI: 10.7270/q2st7r7x
title: BindingDB Entry 50042873: Substituted 7-amino-5-thio-thiazolo[4,5-d]pyrimidines as potent and selective antagonists of the fractalkine receptor (CX3CR1).

description: Small molecule binding data for protein Adenosine receptor A1, C-X3-C chemokine receptor 1, and Interleukin-8 receptors, CXCR2, Uniprot P25025, P30542, and P49238
DOI: 10.7270/q2w66n8g
title: BindingDB Entry 50043956: Synthesis, structure-activity relationships and brain uptake of a novel series of benzopyran inhibitors of insulin-regulated aminopeptidase.

description: Small molecule binding data for protein Cystinyl aminopeptidase, Uniprot Q9UIQ6
DOI: 10.7270/q2wh2rn7
title: BindingDB Entry 50045448: Design, synthesis, and biological evaluation of novel 2-methylpiperazine derivatives as potent CCR5 antagonists.

description: Small molecule binding data for protein C-C chemokine receptor type 5, Uniprot P51681
DOI: 10.7270/q2wm1fz6
title: BindingDB Entry 50044463: Fluorine modulates species selectivity in the triazolopyrimidine class of Plasmodium falciparum dihydroorotate dehydrogenase inhibitors.

description: Small molecule binding data for protein Dihydroorotate Dehydrogenase (DHODH) and Dihydroorotate dehydrogenase, Uniprot O35435, Q02127, and Q63707
DOI: 10.7270/q2ws8vv6
title: BindingDB Entry 50044997: Radiosynthesis and ex vivo evaluation of [(18)F]-(S)-3-(6-(3-fluoropropoxy)benzo[d]isoxazol-3-yl)-5-(methoxymethyl)oxazolidin-2-one for imaging MAO-B with PET.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] B, Uniprot P27338
DOI: 10.7270/q2xk8gxs
title: BindingDB Entry 50042872: Design, synthesis and insulin-sensitising effects of novel PTP1B inhibitors.

description: Small molecule binding data for protein Dual specificity protein phosphatase (VHR), Protein tyrosine phosphatase SHP-2 (SHP-2), Protein-tyrosine phosphatase 1B, and Tyrosine-protein phosphatase non-receptor type 22, Uniprot P18031, P51452, Q06124, and Q9Y2R2
DOI: 10.7270/q20003kg
title: BindingDB Entry 50043963: Discovery of a cyclopentylamine as an orally active dual NK1 receptor antagonist-serotonin reuptake transporter inhibitor.

description: Small molecule binding data for protein Neurokinin 1 receptor, Uniprot P25103
DOI: 10.7270/q2057hc4
title: BindingDB Entry 50043336: Chrysophaentins are competitive inhibitors of FtsZ and inhibit Z-ring formation in live bacteria.

description: Small molecule binding data for protein Cell division protein FtsZ, Uniprot P0A031
DOI: 10.7270/q20866zp
title: BindingDB Entry 50045455: Synthesis and biological evaluation of novel pyrrolidine acid analogs as potent dual PPARa/¿ agonists.

description: Small molecule binding data for protein Cytochrome P450 2C19, Cytochrome P450 2C9, Peroxisome proliferator-activated receptor, and Peroxisome proliferator-activated receptor alpha (PPAR alpha), Uniprot P11712, P33261, P37231, and Q07869
DOI: 10.7270/q20p11r5
title: BindingDB Entry 50045958: Acredinones A and B, voltage-dependent potassium channel inhibitors from the sponge-derived fungus Acremonium sp. F9A015.

description: Small molecule binding data for protein Voltage-gated potassium channel subunit Kv2.1 (Kv2.1), Uniprot Q14721
DOI: 10.7270/q23n24w5
title: BindingDB Entry 50043962: Identification of highly efficacious glucocorticoid receptor agonists with a potential for reduced clinical bone side effects.

description: Small molecule binding data for protein Glucocorticoid receptor, Mineralocorticoid receptor (MR), and Progesterone receptor, Uniprot P04150, P06401, and P08235
DOI: 10.7270/q23x8823
title: BindingDB Entry 50043335: Design, stereoselective synthesis, and biological evaluation of novel tri-cyclic compounds as inhibitor of apoptosis proteins (IAP) antagonists.

description: Small molecule binding data for protein X-linked inhibitor of apoptosis protein (XIAP), Uniprot P98170
DOI: 10.7270/q2416zm4
title: BindingDB Entry 50044469: Novel N-linked aminopiperidine-based gyrase inhibitors with improved hERG and in vivo efficacy against Mycobacterium tuberculosis.

description: Small molecule binding data for protein DNA gyrase subunit B and Voltage-gated potassium channel, Uniprot P0C559 and Q12809
DOI: 10.7270/q2416zqg
title: BindingDB Entry 50045454: Synthesis and biological evaluation of 3-phenyl-3-aryl carboxamido propanoic acid derivatives as small molecule inhibitors of retinoic acid 4-hydroxylase (CYP26A1).

description: Small molecule binding data for protein Cytochrome CYP26A1, Uniprot O43174
DOI: 10.7270/q24f1sgh
title: BindingDB Entry 50045957: a-Ketoamino acid ester derivatives as promising MAO inhibitors.

description: Small molecule binding data for protein Monoamine oxidase and Monoamine oxidase B, Uniprot P21396 and P56560
DOI: 10.7270/q27d2wmh
title: BindingDB Entry 50043961: Synthesis and biological evaluation of novel benzamide derivatives as potent smoothened antagonists.

description: Small molecule binding data for protein G-protein- coupled-like receptor Smoothened (Smo), Uniprot Q99835
DOI: 10.7270/q27s7q93
title: BindingDB Entry 50044468: Orally active 7-substituted (4-benzylphthalazin-1-yl)-2-methylpiperazin-1-yl]nicotinonitriles as active-site inhibitors of sphingosine 1-phosphate lyase for the treatment of multiple sclerosis.

description: Small molecule binding data for protein G-protein- coupled-like receptor Smoothened (Smo) and Sphingosine-1-phosphate lyase 1, Uniprot O95470 and Q99835
DOI: 10.7270/q27s7qfw
title: BindingDB Entry 50045453: Synthesis and biological evaluation of 4-nitroindole derivatives as 5-HT2A receptor antagonists.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 2C (5-HT2C), and 5-Hydroxytryptamine receptor 6 (5-HT6), Uniprot P28223, P28335, and P50406
DOI: 10.7270/q2833tnq
title: BindingDB Entry 50045002: Rodent selectivity of piperidine-4-yl-1H-indoles, a series of CC chemokine receptor-3 (CCR3) antagonists: insights from a receptor model.

description: Small molecule binding data for protein C-C chemokine receptor type 3, Uniprot O54814, P51677, and P51678
DOI: 10.7270/q2c53nb7
title: BindingDB Entry 50043960: A perylene derivative regulates HIF-1a and Stat3 signaling pathways.

description: Small molecule binding data for protein Hypoxia-inducible factor 1-alpha and Signal transducer and activator of transcription 3, Uniprot P40763 and Q16665
DOI: 10.7270/q2cc123c
title: BindingDB Entry 50043333: Discovery of nonbenzamidine factor VIIa inhibitors using a biaryl acid scaffold.

description: Small molecule binding data for protein Coagulation factor VII, Coagulation factor X/antithrombin III, Coagulation factor XI, and Tissue-type plasminogen activator, Uniprot P00742, P00750, P03951, and P08709
DOI: 10.7270/q2cj8g1t
title: BindingDB Entry 50044467: Establishment of a structure-activity relationship of 1H-imidazo[4,5-c]quinoline-based kinase inhibitor NVP-BEZ235 as a lead for African sleeping sickness.

description: Small molecule binding data for protein PI3-kinase subunit alpha, PI3-kinase subunit beta, PI3-kinase subunit delta, PI3-kinase subunit gamma, and Serine/threonine-protein kinase mTOR, Uniprot O00329, P42336, P42338, P42345, and P48736
DOI: 10.7270/q2cj8g5m
title: BindingDB Entry 50045452: Synthesis and pharmacological characterization of 2-aminobenzaldehyde oxime analogs as dual inhibitors of neutrophil elastase and proteinase 3.

description: Small molecule binding data for protein Cathepsin G, Leukocyte elastase, Leukocyte proteinase 3, Neutrophil elastase, and Thrombin, Uniprot P00735, P08246, P08311, P24158, and Q3UP87
DOI: 10.7270/q2cv4kbp
title: BindingDB Entry 50045001: Synthesis, structural characterization and effect on human granulocyte intracellular cAMP levels of abscisic acid analogs.

description: Small molecule binding data for protein LanC-like protein 2, Uniprot Q9NS86
DOI: 10.7270/q2dn46d8
title: BindingDB Entry 50042876: Oxadiazole-isopropylamides as potent and noncovalent proteasome inhibitors.

description: Small molecule binding data for protein 20S proteasome chymotrypsin-like, Uniprot P28074
DOI: 10.7270/q2gq70hk
title: BindingDB Entry 50045962: Design, synthesis and evaluation of scutellarein-O-alkylamines as multifunctional agents for the treatment of Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot O42275, P22303, and P37136
DOI: 10.7270/q2h996r4
title: BindingDB Entry 50044466: Influence of the length and positioning of the antiestrogenic side chain of endoxifen and 4-hydroxytamoxifen on gene activation and growth of estrogen receptor positive cancer cells.

description: Small molecule binding data for protein Estradiol receptor alpha (ERα), Uniprot P03372
DOI: 10.7270/q2hh6mqk
title: BindingDB Entry 50045000: Design of chemically stable, potent, and efficacious MDM2 inhibitors that exploit the retro-mannich ring-opening-cyclization reaction mechanism in spiro-oxindoles.

description: Small molecule binding data for protein E3 ubiquitin-protein ligase Mdm2, Uniprot Q00987
DOI: 10.7270/q2jd4z52
title: BindingDB Entry 50042875: Spirocyclicß-site amyloid precursor protein cleaving enzyme 1 (BACE1) inhibitors: from hit to lowering of cerebrospinal fluid (CSF) amyloidß in a higher species.

description: Small molecule binding data for protein Beta-secretase 1 and Cathepsin D, Uniprot P07339 and P56817
DOI: 10.7270/q2mg7r7x
title: BindingDB Entry 50045961: Cystargolides, 20S Proteasome Inhibitors Isolated from Kitasatospora cystarginea.

description: Small molecule binding data for protein 20S proteasome chymotrypsin-like, Uniprot P28074
DOI: 10.7270/q2mp54sz
title: BindingDB Entry 50043958: Simplified 2-aminoquinoline-based scaffold for potent and selective neuronal nitric oxide synthase inhibition.

description: Small molecule binding data for protein Nitric Oxide Synthase, endothelial, Nitric Oxide Synthase, inducible, and Nitric-oxide synthase, brain, Uniprot P29473, P29476, and P29477
DOI: 10.7270/q2n29zhx
title: BindingDB Entry 50044465: Novel arylsulfonamide derivatives with 5-HT6/5-HT7 receptor antagonism targeting behavioral and psychological symptoms of dementia.

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, Alpha-1A adrenergic receptor, Alpha-2C adrenergic receptor, Dopamine D1 and D2 receptor, Dopamine receptor, Dopamine receptor D2L/neurotensin receptor NTS1, Dopamine receptors; D2 & D4, Histamine H1 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 and norepinephrine transporters (SERT/NET), and Voltage-gated potassium channel, Uniprot P08172, P08173, P08908, P08912, P11229, P14416, P18825, P20309, P21728, P21917, P28223, P28335, P31645, P34969, P35348, P35367, P35462, P50406, Q12809, and Q4W594
DOI: 10.7270/q2n87cdv
title: BindingDB Entry 50044999: (±)-Torreyunlignans A-D, rare 8-9' linked neolignan enantiomers as phosphodiesterase-9A inhibitors from Torreya yunnanensis.

description: Small molecule binding data for protein Phosphodiesterase 9A, Uniprot O76083
DOI: 10.7270/q2p55pvx
title: BindingDB Entry 50042874: Fragment-based drug discovery of 2-thiazolidinones as inhibitors of the histone reader BRD4 bromodomain.

description: Small molecule binding data for protein Bromodomain-containing protein 4, Uniprot O60885
DOI: 10.7270/q2qf8vcx
title: BindingDB Entry 50043965: Discovery of 2-(1H-indazol-1-yl)-thiazole derivatives as selective EP(1) receptor antagonists for treatment of overactive bladder by core structure replacement.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, and Cytochrome P450 2D6 (2D6), Uniprot P05177, P10635, P11712, and P33261
DOI: 10.7270/q2r49shg
title: BindingDB Entry 50045960: Molecular determinants of biased agonism at the dopamine D2 receptor.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), Dopamine D1 and D2 receptor, Dopamine D5 receptor, Dopamine receptor, and Dopamine receptor D2L/neurotensin receptor NTS1, Uniprot P14416, P21728, P21918, P28223, and P35462
DOI: 10.7270/q2s18434
title: BindingDB Entry 50044998: Biological evaluation and structural insights for design of subtype-selective peroxisome proliferator activated receptor-a (PPAR-a) agonists.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Peroxisome proliferator-activated receptor alpha (PPAR alpha), and Peroxisome proliferator-activated receptor delta (PPAR delta), Uniprot P37231, Q03181, and Q07869
DOI: 10.7270/q2vh5qhv
title: BindingDB Entry 50045456: Structural requirements for TLR7-selective signaling by 9-(4-piperidinylalkyl)-8-oxoadenine derivatives.

description: Small molecule binding data for protein Toll-like receptor 7 (TLR7) and Toll-like receptor 8 (TLR8), Uniprot Q9NR97 and Q9NYK1
DOI: 10.7270/q2vx0j7f
title: BindingDB Entry 50045959: Restoration of Chemosensitivity in P-Glycoprotein-Dependent Multidrug-Resistant Cells by Dihydro-ß-agarofuran Sesquiterpenes from Celastrus vulcanicola.

description: Small molecule binding data for protein P-glycoprotein 1, Uniprot P08183
DOI: 10.7270/q20c4x94
title: BindingDB Entry 50044470: Discovery of thienopyrimidine-based FLT3 inhibitors from the structural modification of known IKKß inhibitors.

description: Small molecule binding data for protein Inhibitor of NF-kappa-B kinase (IKK) and Tyrosine-protein kinase receptor FLT3, Uniprot O14920 and P36888
DOI: 10.7270/q20k2b5m
title: BindingDB Entry 50045004: Bioactive constituents from the green alga Caulerpa racemosa.

description: Small molecule binding data for protein Dual specificity phosphatase Cdc25B, Protein tyrosine phosphatase SHP-2 (SHP-2), Protein-tyrosine phosphatase 1B, Protein-tyrosine phosphatase 1C, Receptor-type tyrosine-protein phosphatase F (LAR), and T-cell protein-tyrosine phosphatase, Uniprot P10586, P17706, P18031, P29350, P30305, and Q06124
DOI: 10.7270/q21c1z7t
title: BindingDB Entry 50042879: Design, synthesis, and structure-activity relationship studies of novel 3-alkylindole derivatives as selective and highly potent myeloperoxidase inhibitors.

description: Small molecule binding data for protein Myeloperoxidase (MPO) and Serotonin and norepinephrine transporters (SERT/NET), Uniprot P05164 and P31645
DOI: 10.7270/q22r3t4p
title: BindingDB Entry 50043970: Design, synthesis, pharmacological evaluation, QSAR analysis, molecular modeling and ADMET of novel donepezil-indolyl hybrids as multipotent cholinesterase/monoamine oxidase inhibitors for the potential treatment of Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase and Butyrylcholinesterase (BuChE), Uniprot O42275 and P81908
DOI: 10.7270/q2319xjn
title: BindingDB Entry 50045462: Structure-based design of inhibitors of coagulation factor XIa with novel P1 moieties.

description: Small molecule binding data for protein Coagulation factor IX and X, Coagulation factor VII, Coagulation factor X/antithrombin III, Coagulation factor XI, Kallikrein-1 (KLK1), Plasma kallikrein (KLKB1), Plasminogen, Prothrombin, Tissue-type plasminogen activator, and Trypsin, Uniprot P00734, P00740, P00742, P00747, P00750, P03951, P03952, P06870, P07477, P07478, P08709, and P35030
DOI: 10.7270/q23f4rck
title: BindingDB Entry 50045965: Discovery of Novel Multiacting Topoisomerase I/II and Histone Deacetylase Inhibitors.

description: Small molecule binding data for protein Histone deacetylase, Histone deacetylase 1, and Histone deacetylase 8, Uniprot A0A024QZ26, Q13547, Q92769, Q9BY41, and Q9UBN7
DOI: 10.7270/q24b32xc
title: BindingDB Entry 50045003: 1,2,4-triazolo[1,5-a]quinoxaline derivatives and their simplified analogues as adenosine A3 receptor antagonists. Synthesis, structure-affinity relationships and molecular modeling studies.

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/q2542pxp
title: BindingDB Entry 50042878: Design and synthesis of dual-action inhibitors targeting histone deacetylases and 3-hydroxy-3-methylglutaryl coenzyme A reductase for cancer treatment.

description: Small molecule binding data for protein 3-hydroxy-3-methylglutaryl-coenzyme A reductase (HMG-CoA), Histone deacetylase, and Histone deacetylase 1, Uniprot A0A024QZ26, P04035, Q13547, Q92769, and Q9UBN7
DOI: 10.7270/q2765h2v
title: BindingDB Entry 50045964: Discovery of a Cyclic Boronic Acidß-Lactamase Inhibitor (RPX7009) with Utility vs Class A Serine Carbapenemases.

description: Small molecule binding data for protein Cathepsin A (CTSA), Chymase, Dipeptidyl peptidase 2 (DPP II), Leukocyte elastase, Plasminogen, Prothrombin, Tissue-type plasminogen activator, Trypsin, and Urokinase-type plasminogen activator, Uniprot P00734, P00747, P00749, P00750, P07477, P07478, P08246, P10619, P23946, P35030, and Q9UHL4
DOI: 10.7270/q28w3fn3
title: BindingDB Entry 50042877: Synthesis and evaluation of novel (18)F-labeled spirocyclic piperidine derivatives ass1 receptor ligands for positron emission tomography imaging.

description: Small molecule binding data for protein Anti-estrogen binding site (AEBS), OPIATE Sigma, Sigma, and Vesicular acetylcholine transporter, Uniprot Q15125, Q62666, Q99720, and Q9R0C9
DOI: 10.7270/q2b56m79
title: BindingDB Entry 50043968: Design, synthesis and biological evaluation of 7-nitro-1H-indole-2-carboxylic acid derivatives as allosteric inhibitors of fructose-1,6-bisphosphatase.

description: Small molecule binding data for protein Fructose-1,6-bisphosphatase 1 (FBPase), Uniprot P09467
DOI: 10.7270/q2bk1dwk
title: BindingDB Entry 50044475: Donepezil + propargylamine + 8-hydroxyquinoline hybrids as new multifunctional metal-chelators, ChE and MAO inhibitors for the potential treatment of Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase, Butyrylcholinesterase (BuChE), Monoamine Oxidase Type B (MAO-B), and Monoamine oxidase, Uniprot O42275, P19643, P21396, and P81908
DOI: 10.7270/q2bk1f1s
title: BindingDB Entry 50045460: Discovery of hydroxyaniline amides as selective Extracellular Regulated Kinase (Erk) inhibitors.

description: Small molecule binding data for protein MAP kinase ERK2, Uniprot P28482
DOI: 10.7270/q2bz67sv
title: BindingDB Entry 50045963: Design and synthesis of potent 1,2,4-trisubstituted imidazolinone derivatives with dual p38aMAPK and ERK1/2 inhibitory activity.

description: Small molecule binding data for protein MAP kinase ERK2, Mitogen-activated protein kinase 14, and Mitogen-activated protein kinase 3, Uniprot P27361, P28482, and Q16539
DOI: 10.7270/q2gb25kv
title: BindingDB Entry 50044474: Dual carbonic anhydrase/matrix metalloproteinase inhibitors incorporating bisphosphonic acid moieties targeting bone tumors.

description: Small molecule binding data for protein Carbonic Anhydrase XIV, Carbonic anhydrase, Carbonic anhydrase 12, Carbonic anhydrase 2, Carbonic anhydrase 9, and Collagenase, Uniprot O43570, P00915, P00918, P08253, Q16790, and Q9ULX7
DOI: 10.7270/q2gb25qn
title: BindingDB Entry 50045459: Novel tail and head group prostamide probes.

description: Small molecule binding data for protein Anandamide amidohydrolase, Cannabinoid receptor, Cannabinoid receptor 2, Fatty-acid amide hydrolase 1 (FAAH), Monoglyceride Lipase (MGL), and N-acylethanolamine acid amidase (NAAA), Uniprot O00519, P20272, P34972, P47936, P97612, Q02083, and Q99685
DOI: 10.7270/q2gm88xm
title: BindingDB Entry 50045008: Identification of a highly potent and selective CB2 agonist, RQ-00202730, for the treatment of irritable bowel syndrome.

description: Small molecule binding data for protein Cannabinoid receptor 1, Cannabinoid receptor 2, Cytochrome P450 1A, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), and Cytochrome P450 3A, Uniprot P05177, P08684, P10635, P11712, P21554, and P34972
DOI: 10.7270/q2kp83nk
title: BindingDB Entry 50043966: Integrating docking scores, interaction profiles and molecular descriptors to improve the accuracy of molecular docking: toward the discovery of novel Akt1 inhibitors.

description: Small molecule binding data for protein AKT/p21CIP1, Uniprot P31749
DOI: 10.7270/q2kw5hg7
title: BindingDB Entry 50043339: Octahydropyrrolo[3,4-c]pyrrole negative allosteric modulators of mGlu1.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Metabotropic glutamate receptor 1, and Metabotropic glutamate receptor 5, Uniprot P05177, P10635, P11712, P41594, and Q13255
DOI: 10.7270/q2m32x96
title: BindingDB Entry 50044473: Multivalent design of long-actingß(2)-adrenoceptor agonists incorporating biarylamines.

description: Small molecule binding data for protein Beta-1 adrenergic receptor, Beta-2 adrenergic receptor, Beta-2 adrenergic receptor and beta-3 adrenergic receptor, and Beta-3 adrenergic receptor, Uniprot P07550, P08588, P13945, and Q8K4Z4
DOI: 10.7270/q2m32xdj
title: BindingDB Entry 50045458: Inhibition of monoamine oxidase by indole-5,6-dicarbonitrile 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/q2n58nr0
title: BindingDB Entry 50042882: Structure-based approaches to ligands for G-protein-coupled adenosine and P2Y receptors, from small molecules to nanoconjugates.

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/q2q81fsz
title: BindingDB Entry 50045968: Discovery of a Dual PRMT5-PRMT7 Inhibitor.

description: Small molecule binding data for protein DNA (cytosine-5)-methyltransferase 3B, DNMT3A2/3L complex, PRMT5/MEP50 complex, Protein arginine methyltransferase 5 (PRMT5), and Protein arginine methyltransferase 7 (PRMT7), Uniprot O14744, Q9BQA1, Q9NVM4, Q9UBC3, and Q9Y6K1
DOI: 10.7270/q2qn687d
title: BindingDB Entry 50043338: A hit to lead discovery of novel N-methylated imidazolo-, pyrrolo-, and pyrazolo-pyrimidines as potent and selective mTOR inhibitors.

description: Small molecule binding data for protein PI3-kinase subunit alpha, PI3-kinase subunit delta, and Serine/threonine-protein kinase mTOR, Uniprot O00329, P42336, and P42345