cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2nz88cf
title: BindingDB Entry 50037142: Structure-activity relationships of dynorphin a analogues modified in the address sequence.

description: Small molecule binding data for protein Delta-type opioid receptor, Kappa-type opioid receptor, Mu-type opioid receptor, and mu/kappa opioid receptor, Uniprot P35372, P41143, P41145, and P97266
DOI: 10.7270/q2rj4kdw
title: BindingDB Entry 50039002: Structure-activity relationship study of betulinic acid, a novel and selective TGR5 agonist, and its synthetic derivatives: potential impact in diabetes.

description: Small molecule binding data for protein Bile acid receptor FXR and G-protein coupled bile acid receptor 1, Uniprot Q8TDU6 and Q96RI1
DOI: 10.7270/q2sn09p0
title: BindingDB Entry 50037141: Calculation of the binding affinity of beta-secretase inhibitors using the linear interaction energy method.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot P56817
DOI: 10.7270/q2w95b4m
title: BindingDB Entry 50039001: Human P2Y(14) receptor agonists: truncation of the hexose moiety of uridine-5'-diphosphoglucose and its replacement with alkyl and aryl groups.

description: Small molecule binding data for protein Purinergic receptor P2Y14 and Pyrimidinergic receptor P2Y6, Uniprot Q15077 and Q15391
DOI: 10.7270/q2w95b6h
title: BindingDB Entry 50039823: Binding of ibuprofen, ketorolac, and diclofenac to COX-1 and COX-2 studied by saturation transfer difference NMR.

description: Small molecule binding data for protein Cyclooxygenase, Prostaglandin G/H synthase (Cyclooxygenase-2), and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979, P35354, and P79208
DOI: 10.7270/q2ww7jhn
title: BindingDB Entry 50038082: Synthesis of potent pyrrolidine influenza neuraminidase inhibitors.

description: Small molecule binding data for protein Neuraminidase B, Uniprot P03474
DOI: 10.7270/q2x92cbw
title: BindingDB Entry 50039815: Discovery of CX-6258. A Potent, Selective, and Orally Efficacious pan-Pim Kinases Inhibitor.

description: Small molecule binding data for protein Serine/threonine-protein kinase PIM and Tyrosine-protein kinase receptor FLT3, Uniprot P11309, P36888, Q86V86, and Q9P1W9
DOI: 10.7270/q2xd12c8
title: BindingDB Entry 50037140: Understanding the structure-activity relationship of the human ether-a-go-go-related gene cardiac K+ channel. A model for bad behavior.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-hydroxytryptamine receptor 4 (5-HT4), Dopamine receptor D2L/neurotensin receptor NTS1, Histamine H1 receptor, and Voltage-gated potassium channel, Uniprot P14416, P28223, P35367, Q12809, and Q13639
DOI: 10.7270/q2028shk
title: BindingDB Entry 50039008: Probing Torpedo californica acetylcholinesterase catalytic gorge with two novel bis-functional galanthamine derivatives.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot P22303
DOI: 10.7270/q2028skg
title: BindingDB Entry 50039830: Inhibition of homologous recombination in human cells by targeting RAD51 recombinase.

description: Small molecule binding data for protein DNA repair protein RAD51 homolog 1, Uniprot Q06609
DOI: 10.7270/q2154hsp
title: BindingDB Entry 50037147: Angiotensin II AT1 receptor antagonists. Clinical implications of active metabolites.

description: Small molecule binding data for protein Angiotensin II receptor, Uniprot P30556
DOI: 10.7270/q22v2h2q
title: BindingDB Entry 50039015: Design, synthesis, and docking studies of novel benzimidazoles for the treatment of metabolic syndrome.

description: Small molecule binding data for protein AGTR1 and Peroxisome proliferator-activated receptor alpha (PPAR alpha), Uniprot P25095 and Q07869
DOI: 10.7270/q23f4qgh
title: BindingDB Entry 50038096: Novel inhibitors of the Gardos channel for the treatment of sickle cell disease.

description: Small molecule binding data for protein Intermediate conductance calcium-activated potassium channel protein 4, Uniprot O15554
DOI: 10.7270/q23t9j6j
title: BindingDB Entry 50039007: Synthesis, biological evaluation, X-ray structure, and pharmacokinetics of aminopyrimidine c-jun-N-terminal kinase (JNK) inhibitors.

description: Small molecule binding data for protein Mitogen-activated protein kinase 10 and c-Jun N-terminal kinase, JNK, Uniprot P45983 and P53779
DOI: 10.7270/q23t9j8f
title: BindingDB Entry 50039829: Synthesis and biological evaluation of pyrimidine-based dual inhibitors of human epidermal growth factor receptor 1 (HER-1) and HER-2 tyrosine kinases.

description: Small molecule binding data for protein 5'-AMP-activated protein kinase catalytic subunit alpha-1, Cyclin-Dependent Kinase 1 (CDK1), Dual specificity mitogen-activated protein kinase kinase 1, Epidermal growth factor receptor, Epidermal growth factor receptor and ErbB2 (HER1 and HER2), Fibroblast growth factor receptor 1, Focal adhesion kinase 1/vascular endothelial growth factor receptor 3, Hepatocyte growth factor receptor, Insulin receptor, Insulin-like growth factor I receptor, Platelet-derived growth factor receptor, Platelet-derived growth factor receptor beta, Receptor tyrosine-protein kinase erbB-4 (HER4), Serine/threonine-protein kinase 11, Serine/threonine-protein kinase Aurora, Serine/threonine-protein kinase PIM, Tyrosine-protein kinase ABL1, Tyrosine-protein kinase JAK2, Tyrosine-protein kinase Kit (Kit), Tyrosine-protein kinase SYK, Tyrosine-protein kinase receptor FLT3, and Vascular endothelial growth factor receptor, Uniprot L7RSL3, O14965, O60674, P00519, P00533, P04626, P06213, P06493, P08069, P08581, P09619, P10721, P11309, P11362, P14635, P16234, P17948, P36888, P43405, Q02750, Q05397, Q13131, Q15303, and Q15831
DOI: 10.7270/q23x87cq
title: BindingDB Entry 50037154: Synthesis and biological evaluation of 18-methoxycoronaridine congeners. Potential antiaddiction agents.

description: Small molecule binding data for protein Delta-type opioid receptor, Neuronal acetylcholine receptor protein alpha-3/beta-4 subunit, and mu/kappa opioid receptor, Uniprot P30926, P32297, P41143, P41144, and P97266
DOI: 10.7270/q24x58h3
title: BindingDB Entry 50037146: Interaction of cis-(6-benzhydrylpiperidin-3-yl)benzylamine analogues with monoamine transporters: structure-activity relationship study of structurally constrained 3,6-disubstituted piperidine analogues of (2,2-diphenylethyl)-[1-(4-fluorobenzyl)piperidin-4-ylmethyl]amine.

description: Small molecule binding data for protein Dopamine Transporter (DAT), Norepinephrine Monoamine transporters, and Sodium-dependent serotonin transporter, Uniprot P23977 and P31652
DOI: 10.7270/q2736rsh
title: BindingDB Entry 50038095: A new series of neutral 5-substituted 4-anilinoquinazolines as potent, orally active inhibitors of erbB2 receptor tyrosine kinase.

description: Small molecule binding data for protein Epidermal growth factor receptor, Epidermal growth factor receptor and ErbB2 (HER1 and HER2), and Voltage-gated potassium channel, Uniprot P00533, P04626, and Q12809
DOI: 10.7270/q27m090q
title: BindingDB Entry 50039828: Cycloartane and friedelane triterpenoids from the leaves of Caloncoba glauca and their evaluation for inhibition of 11ß-hydroxysteroid dehydrogenases.

description: Small molecule binding data for protein 11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2), 11-beta-hydroxysteroid dehydrogenase 1, and 11-beta-hydroxysteroid dehydrogenase 2, Uniprot P28845, P50172, P51661, and P80365
DOI: 10.7270/q2bc40g9
title: BindingDB Entry 50039013: Rational design of indoleamine 2,3-dioxygenase inhibitors.

description: Small molecule binding data for protein Indoleamine 2,3-dioxygenase, Indoleamine 2,3-dioxygenase 1, and Tryptophan 2,3-dioxygenase, Uniprot P14902, P28776, and P48776
DOI: 10.7270/q2bv7hgg
title: BindingDB Entry 50038094: Alpha,beta-cyclic-beta-benzamido hydroxamic acids: novel templates for the design, synthesis, and evaluation of selective inhibitors of TNF-alpha converting enzyme (TACE).

description: Small molecule binding data for protein ADAM17, Collagenase, Matrix Metalloproteinase-8 (MMP-8), Matrix metalloproteinase 10, Matrix metalloproteinase 15, Matrix metalloproteinase-1 (MMP1), Matrix metalloproteinase-12 (MMP12), Matrix metalloproteinase-14 (MMP14), Matrix metalloproteinase-7 (MMP7), and Stromelysin-1, Uniprot O77636, P03956, P08253, P08254, P09237, P09238, P14780, P22894, P39900, P45452, P50281, and P51511
DOI: 10.7270/q2cc11rg
title: BindingDB Entry 50039827: Discovery of the macrocycle (9E)-15-(2-(pyrrolidin-1-yl)ethoxy)-7,12,25-trioxa-19,21,24-triaza-tetracyclo[18.3.1.1(2,5).1(14,18)]hexacosa-1(24),2,4,9,14(26),15,17,20,22-nonaene (SB1578), a potent inhibitor of janus kinase 2/fms-like tyrosine kinase-3 (JAK2/FLT3) for the treatment of rheumatoid arth

description: Small molecule binding data for protein Cyclin-dependent kinase 2, Cyclin-dependent kinase 9, Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, JAK2/TYK2, JAK3/JAK1, Macrophage colony stimulating factor receptor, Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, Tyrosine-protein kinase receptor FLT3, and Voltage-gated potassium channel, Uniprot O60674, P05177, P07333, P08684, P10635, P11712, P23458, P24941, P29597, P33261, P36888, P50750, P52333, and Q12809
DOI: 10.7270/q2df6rzr
title: BindingDB Entry 50037144: Synthesis of chiral 1-[omega-(4-chlorophenoxy)alkyl]-4-methylpiperidines and their biological evaluation at sigma1, sigma2, and sterol delta8-delta7 isomerase sites.

description: Small molecule binding data for protein 3-beta-hydroxysteroid-delta(8),delta(7)-isomerase and Sigma, Uniprot Q60490 and Q99720
DOI: 10.7270/q2g161s9
title: BindingDB Entry 50039012: Antiangiogenic effect of dual/selective alpha(5)beta(1)/alpha(v)beta(3) integrin antagonists designed on partially modified retro-inverso cyclotetrapeptide mimetics.

description: Small molecule binding data for protein Fibronectin receptor beta/Integrin alpha5 and Integrin beta-3/Vitronectin receptor alpha, Uniprot P05106, P05556, P06756, and P08648
DOI: 10.7270/q2gm8849
title: BindingDB Entry 50038093: Alpha-hydroxy amides as a novel class of bradykinin B1 selective antagonists.

description: Small molecule binding data for protein BDKRB1, Bradykinin B1 receptor, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), and Cytochrome P450 3A, Uniprot P08684, P10635, P11712, P46663, P48748, P97583, and Q9BDQ5
DOI: 10.7270/q2h41sgt
title: BindingDB Entry 50039826: Diverse heterocyclic scaffolds as allosteric inhibitors of AKT.

description: Small molecule binding data for protein AKT/p21CIP1, Uniprot P31749
DOI: 10.7270/q2h70gjn
title: BindingDB Entry 50037151: Dual probes for the dopamine transporter and sigma1 receptors: novel piperazinyl alkyl-bis(4'-fluorophenyl)amine analogues as potential cocaine-abuse therapeutic agents.

description: Small molecule binding data for protein Dopamine Transporter (DAT), Norepinephrine Monoamine transporters, OPIATE Sigma, Sigma, and Sodium-dependent serotonin transporter, Uniprot P23977, P31652, Q99720, and Q9R0C9
DOI: 10.7270/q2j67hpg
title: BindingDB Entry 50037143: Rational design and synthesis of an orally active indolopyridone as a novel conformationally constrained cannabinoid ligand possessing antiinflammatory properties.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot P21554 and P34972
DOI: 10.7270/q2ks6sgw
title: BindingDB Entry 50039011: Novel synthesis of the hexahydroimidazo[1,5b]isoquinoline scaffold: application to the synthesis of glucocorticoid receptor modulators.

description: Small molecule binding data for protein Androgen Receptor, Glucocorticoid receptor, and Progesterone receptor, Uniprot P04150, P06401, and P10275
DOI: 10.7270/q2ms3tsh
title: BindingDB Entry 50039825: Pyridyl-2,5-diketopiperazines as potent, selective, and orally bioavailable oxytocin antagonists: synthesis, pharmacokinetics, and in vivo potency.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Oxytocin receptor, Vasopressin V1a receptor (V1a), Vasopressin V1b receptor, and Vasopressin V2 receptor (V2), Uniprot P05177, P08684, P10635, P11712, P30518, P30559, P33261, P37288, and P47901
DOI: 10.7270/q2n0178c
title: BindingDB Entry 50037150: Synthesis and structure-activity relationship of N-substituted 4-arylsulfonylpiperidine-4-hydroxamic acids as novel, orally active matrix metalloproteinase inhibitors for the treatment of osteoarthritis.

description: Small molecule binding data for protein ADAM17, Collagenase, Matrix Metalloproteinase-8 (MMP-8), Matrix metalloproteinase-1 (MMP1), Matrix metalloproteinase-14 (MMP14), Matrix metalloproteinase-7 (MMP7), and Stromelysin-1, Uniprot P03956, P08253, P08254, P09237, P14780, P22894, P45452, P50281, and P78536
DOI: 10.7270/q2qj7j72
title: BindingDB Entry 50039010: Novel synthesis and structural characterization of a high-affinity paramagnetic kinase probe for the identification of non-ATP site binders by nuclear magnetic resonance.

description: Small molecule binding data for protein Aurora kinase B/Inner centromere protein, CDK2/Cyclin A/Cyclin A1, Casein kinase I, Cyclin B/Cyclin-Dependent Kinase 1 (CDK1)/G2/mitotic-specific cyclin B2/G2/mitotic-specific cyclin B3, MAP kinase ERK2, MAP kinase-activated protein kinase 2, Mitogen-activated protein kinase 14, Mitogen-activated protein kinase 2, Platelet-derived growth factor receptor, Protein kinase C alpha type, Ribosomal protein S6 kinase alpha 1, SRC, Tyrosine-protein kinase ABL1, VEGF-receptor 2 and tyrosine-protein kinase SRC, and Vascular endothelial growth factor receptor 2, Uniprot O95067, P00519, P06239, P06241, P06493, P08631, P12931, P14635, P16234, P17252, P20248, P24941, P28482, P35968, P49137, P78396, Q12851, Q15418, Q16539, Q8WWL7, Q96GD4, and Q9HCP0
DOI: 10.7270/q2r49rmd
title: BindingDB Entry 50038091: Synthesis and biological activity of piperazine and diazepane amides that are histamine H3 antagonists and serotonin reuptake inhibitors.

description: Small molecule binding data for protein Histamine receptor (H3), Serotonin and norepinephrine transporters (SERT/NET), Sodium-dependent dopamine transporter, Sodium-dependent noradrenaline transporter, and Sodium-dependent serotonin transporter, Uniprot P23975, P31645, P31652, Q01959, and Q9Y5N1
DOI: 10.7270/q2rj4kgs
title: BindingDB Entry 50039824: Exploring activity cliffs in medicinal chemistry.

description: Small molecule binding data for protein Adenosine receptor A1, Cathepsin (B and K), Cathepsin L1, Cyclooxygenase, Cyclooxygenase-1 (COX-1), and Vascular endothelial growth factor receptor 2, Uniprot P07711, P07858, P23219, P30542, P35354, and P35968
DOI: 10.7270/q2rr1zzj
title: BindingDB Entry 50037149: Synthesis and structure-activity relationship of alpha-sulfonylhydroxamic acids as novel, orally active matrix metalloproteinase inhibitors for the treatment of osteoarthritis.

description: Small molecule binding data for protein ADAM17, Collagenase, and Matrix metalloproteinase-1 (MMP1), Uniprot P03956, P14780, P45452, and P78536
DOI: 10.7270/q2tx3g60
title: BindingDB Entry 50038098: Discovery of disubstituted cyclohexanes as a new class of CC chemokine receptor 2 antagonists.

description: Small molecule binding data for protein C-C chemokine receptor type 2, Uniprot O95950 and P41597
DOI: 10.7270/q2v9891p
title: BindingDB Entry 50039009: Novel 3-arylideneindolin-2-ones as inhibitors of NAD+ -dependent histone deacetylases (sirtuins).

description: Small molecule binding data for protein NAD-Dependent Deacetylase Sirtuin-1, NAD-dependent deacetylase sirtuin 2, and NAD-dependent protein deacetylase sirtuin-3 (SIRT3), Uniprot Q8IXJ6, Q96EB6, and Q9NTG7
DOI: 10.7270/q2vx0hct
title: BindingDB Entry 50038090: Discovery of new MurF inhibitors via pharmacophore modeling and QSAR analysis followed by in-silico screening.

description: Small molecule binding data for protein MurF (S. pneumoniae) and UDP-N-acetylmuramoyl-tripeptide--D-alanyl-D-alanine ligase
DOI: 10.7270/q2wd41b7
title: BindingDB Entry 50037148: Three dimensional pharmacophore modeling of human CYP17 inhibitors. Potential agents for prostate cancer therapy.

description: Small molecule binding data for protein Cytochrome P450 17A1, Uniprot P05093
DOI: 10.7270/q2zp46zr
title: BindingDB Entry 50038097: Meriolins (3-(pyrimidin-4-yl)-7-azaindoles): synthesis, kinase inhibitory activity, cellular effects, and structure of a CDK2/cyclin A/meriolin complex.

description: Small molecule binding data for protein Cyclin-Dependent Kinase 2 (CDK2), Cyclin-Dependent Kinase 5 (CDK5), Cyclin-Dependent Kinase 9 (CDK9), and Dual-specificity tyrosine-(Y)-phosphorylation regulated kinase 1A, Uniprot O60563, P20248, P24941, P50750, Q00535, Q15078, and Q63470
DOI: 10.7270/q2057gpr
title: BindingDB Entry 50037155: Synthesis of substituted 6-anilinouracils and their inhibition of DNA polymerase IIIC and Gram-positive bacterial growth.

description: Small molecule binding data for protein DNA polymerase IIIC, Uniprot P13267
DOI: 10.7270/q21v5fwg
title: BindingDB Entry 50039023: Identification and characterization of novel sirtuin inhibitor scaffolds.

description: Small molecule binding data for protein NAD-Dependent Deacetylase Sirtuin-1 and NAD-dependent deacetylase HST2, Uniprot P53686 and Q96EB6
DOI: 10.7270/q22f7p9p
title: BindingDB Entry 50038104: Substituted oxazolidinones as novel NPC1L1 ligands for the inhibition of cholesterol absorption.

description: Small molecule binding data for protein Niemann-Pick C1-like protein 1, Uniprot Q6T3U3
DOI: 10.7270/q22v2h4m
title: BindingDB Entry 50039837: Bis-spirolabdane diterpenoids from Leonotis nepetaefolia.

description: Small molecule binding data for protein Dopamine D5 receptor, Histamine H2 Receptor, and Muscarinic acetylcholine receptor, Uniprot P20309, P21918, and P25021
DOI: 10.7270/q2668f1d
title: BindingDB Entry 50038103: Design and optimization of imidazole derivatives as potent CXCR3 antagonists.

description: Small molecule binding data for protein chemokine (C-X-C motif) receptor 3, Uniprot P49682
DOI: 10.7270/q26m37s1
title: BindingDB Entry 50039014: Isosorbide-2-benzyl carbamate-5-salicylate, a peripheral anionic site binding subnanomolar selective butyrylcholinesterase inhibitor.

description: Small molecule binding data for protein Acetylcholinesterase, Carboxylesterase 2, and Cholinesterase, Uniprot O00748, O42275, and P06276
DOI: 10.7270/q26m37vx
title: BindingDB Entry 50039836: Substituted phenoxypropyl-(R)-2-methylpyrrolidine aminomethyl ketones as histamine-3 receptor inverse agonists.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Histamine H3 receptor, and Histamine receptor (H3), Uniprot P05177, P08684, P10635, P11712, P33261, Q9QYN8, and Q9Y5N1
DOI: 10.7270/q27p903f
title: BindingDB Entry 50037153: The most potent organophosphorus inhibitors of leucine aminopeptidase. Structure-based design, chemistry, and activity.

description: Small molecule binding data for protein Aminopeptidase N and Leucine aminopeptidase, Uniprot P15145 and P28838
DOI: 10.7270/q29c6zc0
title: BindingDB Entry 50039021: Novel 2H-isoquinolin-3-ones as antiplasmodial falcipain-2 inhibitors.

description: Small molecule binding data for protein Cathepsin (B and K), Cathepsin L1, and Rhodesain, Uniprot P07711 and P07858
DOI: 10.7270/q29w0gbn
title: BindingDB Entry 50038102: Synthesis, biological evaluation and molecular modelling studies of methyleneimidazole substituted biaryls as inhibitors of human 17alpha-hydroxylase-17,20-lyase (CYP17). Part I: Heterocyclic modifications of the core structure.

description: Small molecule binding data for protein Cytochrome P450 17A1, Uniprot P05093 and P11715
DOI: 10.7270/q2bc40kn
title: BindingDB Entry 50039835: Discovery of Plasmodium vivax N-myristoyltransferase inhibitors: screening, synthesis, and structural characterization of their binding mode.

description: Small molecule binding data for protein Myristoyl-CoA:protein N-myristoyltransferase (Nmt) and Peptide N-myristoyltransferase 2, Uniprot O60551 and P30419
DOI: 10.7270/q2cf9qtc
title: BindingDB Entry 50037152: Discovery and structural modification of inhibitors of methionine aminopeptidases from Escherichia coli and Saccharomyces cerevisiae.

description: Small molecule binding data for protein Methionine Aminopeptidase (MAP) and Methionine aminopeptidase 1, Uniprot P0AE18 and Q01662
DOI: 10.7270/q2f47q28
title: BindingDB Entry 50039020: Identification of new agonists of urotensin-II from a cyclic peptide library.

description: Small molecule binding data for protein Urotensin II receptor, Uniprot Q9UKP6
DOI: 10.7270/q2fn171x
title: BindingDB Entry 50038101: Multi-target-directed coumarin derivatives: hAChE and BACE1 inhibitors as potential anti-Alzheimer compounds.

description: Small molecule binding data for protein Acetylcholinesterase and Beta-secretase 1, Uniprot P22303 and P56817
DOI: 10.7270/q2g44rbf
title: BindingDB Entry 50039834: Polyhydroxylated macrolides from Seimatosporium discosioides and their effects on the activation of peroxisome proliferator-activated receptor gamma.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Uniprot P37231
DOI: 10.7270/q2js9rdd
title: BindingDB Entry 50039019: A critical electrostatic interaction mediates inhibitor recognition by human asparagine synthetase.

description: Small molecule binding data for protein Asparagine synthetase, Uniprot P08243
DOI: 10.7270/q2kd1zqd
title: BindingDB Entry 50038100: Cyclic guanidines as dual 5-HT5A/5-HT7 receptor ligands: structure-activity relationship elucidation.

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 1D, Histamine H1 receptor, Serotonin (5-HT) receptor, Serotonin 3 (5-HT3) receptor, and Serotonin receptor (2b and 2c), Uniprot P08908, P28221, P28223, P28335, P34969, P35367, P41595, P46098, P47898, and P50406
DOI: 10.7270/q2kw5h2v
title: BindingDB Entry 50039833: First-in-class, dual-action, 3,5-disubstituted indole derivatives having human nitric oxide synthase (nNOS) and norepinephrine reuptake inhibitory (NERI) activity for the treatment of neuropathic pain.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Nitric oxide synthase, brain, Nitric oxide synthase, inducible, Nitric-oxide synthase (endothelial and brain), Sodium-dependent noradrenaline transporter, and Voltage-gated potassium channel, Uniprot P05177, P08684, P10635, P11712, P23975, P29475, P33261, P35228, and Q12809
DOI: 10.7270/q2pk0h37
title: BindingDB Entry 50039018: Synthesis and pharmacological evaluation of 6-naltrexamine analogs for alcohol cessation.

description: Small molecule binding data for protein Delta-type opioid receptor, Kappa-type opioid receptor, Mu-type opioid receptor, and Nociceptin receptor, Uniprot P35372, P41143, P41145, and P41146
DOI: 10.7270/q2pn96ns
title: BindingDB Entry 50039840: Benzothiazoles as probes for the 5HT1A receptor and the serotonin transporter (SERT): a search for new dual-acting agents as potential antidepressants.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 2C (5-HT2C), 5-Hydroxytryptamine receptor 7 (5-HT7), 5-hydroxytryptamine receptor 1A, Dopamine receptor, Dopamine receptor D2L/neurotensin receptor NTS1, Histamine H1 receptor, Serotonin and norepinephrine transporters (SERT/NET), Sodium-dependent dopamine transporter, and Sodium-dependent noradrenaline transporter, Uniprot P08908, P14416, P23975, P28223, P28335, P30729, P31645, P34969, P35367, and Q01959