Compile Data Set for Download or QSAR
Found 71 Enz. Inhib. hit(s) with all data for entry = 50038080
Target5-hydroxytryptamine receptor 3A(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50110300(CHEMBL15056 | N-(4-(3-(piperidin-1-yl)propoxy)phen...)copy SMILEScopy InChI
Affinity DataKi:  0.330nMAssay Description:Binding affinity to 5HT3 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231951(2,5-bis(6-((2-methoxybenzyl)(ethyl)amino)hexylamin...)copy SMILEScopy InChI
Affinity DataKi:  2.60nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
Target5-hydroxytryptamine receptor 3A(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50166984(3-Methyl-2-(4-methyl-piperazin-1-yl)-quinoline-4-c...)copy SMILEScopy InChI
Affinity DataKi:  5.60nMAssay Description:Binding affinity to 5HT3 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50037429(8-(3-chlorostyryl)caffeine | 8-[(E)-2-(3-chlorophe...)copy SMILEScopy InChI
Affinity DataKi:  36nMAssay Description:Antagonist activity against adenosine A2 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] B(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50037429(8-(3-chlorostyryl)caffeine | 8-[(E)-2-(3-chlorophe...)copy SMILEScopy InChI
Affinity DataKi:  70nMAssay Description:Inhibition of MAOBMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM9012(7-(6,8-Dichloro-1,2,3,4-tetrahydro-acridin-9-ylami...)copy SMILEScopy InChI
Affinity DataIC50: 0.00800nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM9022(CHEMBL225567 | Indole-Tacrine Heterodimer 5 | N-[5...)copy SMILEScopy InChI
Affinity DataIC50: 0.0200nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM9023(CHEMBL225198 | Indole-Tacrine Heterodimer 6 | N-[7...)copy SMILEScopy InChI
Affinity DataIC50: 0.0600nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM10512(CHEMBL194823 | N-{3-[(6-chloro-1,2,3,4-tetrahydroa...)copy SMILEScopy InChI
Affinity DataIC50: 0.25nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM10692(3-{[methyl({3-[(9-oxo-9H-xanthen-3-yl)oxy]propyl})...)copy SMILEScopy InChI
Affinity DataIC50: 0.300nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50106731((+)-alpha-Lipoic acid | (R)-(+)-lipoic acid | (R)-...)copy SMILEScopy InChI
Affinity DataIC50: 1nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50158582(3,8-Diamino-6-phenyl-5-(3-{3-[3-(1,2,3,4-tetrahydr...)copy SMILEScopy InChI
Affinity DataIC50: 1.60nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50110300(CHEMBL15056 | N-(4-(3-(piperidin-1-yl)propoxy)phen...)copy SMILEScopy InChI
Affinity DataIC50: 2.60nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50157597(6-[ethyl-(2-methoxy-benzyl)-amino]-1-(1'-{6-[ethyl...)copy SMILEScopy InChI
Affinity DataIC50: 3.30nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] B(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231957(7-(3-Chloro-benzyloxy)-3,4-dimethyl-chromen-2-one ...)copy SMILEScopy InChI
Affinity DataIC50: 3.30nMAssay Description:Inhibition of MAOBMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50166984(3-Methyl-2-(4-methyl-piperazin-1-yl)-quinoline-4-c...)copy SMILEScopy InChI
Affinity DataIC50: 4.10nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] B(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM10989((1R)-N-(prop-2-yn-1-yl)-2,3-dihydro-1H-inden-1-ami...)copy SMILEScopy InChI
Affinity DataIC50: 4.40nMAssay Description:Inhibition of MAOBMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetD(2) dopamine receptor(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50027256(Sarizotan)copy SMILEScopy InChI
Affinity DataIC50: 6nMAssay Description:Binding affinity to human dopaminergic D2 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetD(3) dopamine receptor(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50027256(Sarizotan)copy SMILEScopy InChI
Affinity DataIC50: 6nMAssay Description:Binding affinity to human dopaminergic D3 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
Target5-hydroxytryptamine receptor 3A(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50027256(Sarizotan)copy SMILEScopy InChI
Affinity DataIC50: 6nMAssay Description:Binding affinity to 5HT3 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
Target5-hydroxytryptamine receptor 1A(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50027256(Sarizotan)copy SMILEScopy InChI
Affinity DataIC50: 6nMAssay Description:Binding affinity to human 5HT1A receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetD(4) dopamine receptor(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50027256(Sarizotan)copy SMILEScopy InChI
Affinity DataIC50: 6nMAssay Description:Binding affinity to human dopaminergic D4 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] B(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM15579(CHEMBL972 | DEPRENYL | L-Deprenyl | N-methyl-N-[(2...)copy SMILEScopy InChI
Affinity DataIC50: 7nMAssay Description:Inhibition of MAOBMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM8960((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...)copy SMILEScopy InChI
Affinity DataIC50: 23nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231954(6-[ethyl-(2-methoxy-benzyl)-amino]-hexanoic acid (...)copy SMILEScopy InChI
Affinity DataIC50: 36nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] A(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231950(4-((methyl(prop-2-ynyl)amino)methyl)quinolin-8-ol ...)copy SMILEScopy InChI
Affinity DataIC50: 37nMAssay Description:Inhibition of MAOAMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetCholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50166984(3-Methyl-2-(4-methyl-piperazin-1-yl)-quinoline-4-c...)copy SMILEScopy InChI
Affinity DataIC50: 40nMAssay Description:Inhibition of human BuchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50175500((S)-4-(1-(methylamino)-3-(4-nitrophenoxy)propyl)ph...)copy SMILEScopy InChI
Affinity DataIC50: 42nMAssay Description:Inhibition of SERTMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM29400(CHEMBL374184 | tacrine-dihydropyridine hybrid (tac...)copy SMILEScopy InChI
Affinity DataIC50: 45nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM10949(3-(4-{[Benzyl(methyl)amino]methyl}-phenyl)-6,7-dim...)copy SMILEScopy InChI
Affinity DataIC50: 45nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] B(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231950(4-((methyl(prop-2-ynyl)amino)methyl)quinolin-8-ol ...)copy SMILEScopy InChI
Affinity DataIC50: 57nMAssay Description:Inhibition of MAOBMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231956((Z)-8-bromo-4-methyl-3-(methylimino)-1,2,3,4-tetra...)copy SMILEScopy InChI
Affinity DataIC50: 60nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50175500((S)-4-(1-(methylamino)-3-(4-nitrophenoxy)propyl)ph...)copy SMILEScopy InChI
Affinity DataIC50: 101nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetBeta-secretase 1(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231951(2,5-bis(6-((2-methoxybenzyl)(ethyl)amino)hexylamin...)copy SMILEScopy InChI
Affinity DataIC50: 108nMAssay Description:Inhibition of BACE1More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50067482(6-[(2-Methoxy-benzyl)-methyl-amino]-hexanoic acid ...)copy SMILEScopy InChI
Affinity DataIC50: 170nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM30130(CHEMBL1201082 | CHEMBL41 | Fluoxetin | Fluoxetine ...)copy SMILEScopy InChI
Affinity DataIC50: 180nMAssay Description:Inhibition of SERTMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMedDrugBank
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50041517(4-[(2,6-dichloro-benzyloxyimino)-methyl]-1-(3-phen...)copy SMILEScopy InChI
Affinity DataIC50: 180nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] A(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM10989((1R)-N-(prop-2-yn-1-yl)-2,3-dihydro-1H-inden-1-ami...)copy SMILEScopy InChI
Affinity DataIC50: 410nMAssay Description:Inhibition of MAOAMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM8961(1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...)copy SMILEScopy InChI
Affinity DataIC50: 420nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
TargetAmine oxidase [flavin-containing] A(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231956((Z)-8-bromo-4-methyl-3-(methylimino)-1,2,3,4-tetra...)copy SMILEScopy InChI
Affinity DataIC50: 540nMAssay Description:Inhibition of MAOAMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM10620((S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)...)copy SMILEScopy InChI
Affinity DataIC50: 920nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMedDrugBank
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231961(3,8-diamino-5-(3-{3-[3-(2-methoxy-benzylamino)-pro...)copy SMILEScopy InChI
Affinity DataIC50: 952nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM10620((S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)...)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of SERTMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] A(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231957(7-(3-Chloro-benzyloxy)-3,4-dimethyl-chromen-2-one ...)copy SMILEScopy InChI
Affinity DataIC50: 1.12E+3nMAssay Description:Inhibition of MAOAMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] A(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM15579(CHEMBL972 | DEPRENYL | L-Deprenyl | N-methyl-N-[(2...)copy SMILEScopy InChI
Affinity DataIC50: 1.20E+3nMAssay Description:Inhibition of MAOAMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] B(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM10826(3-{2-[methyl(prop-2-yn-1-yl)amino]propyl}phenyl N-...)copy SMILEScopy InChI
Affinity DataIC50: 1.50E+3nMAssay Description:Inhibition of MAOBMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM9022(CHEMBL225567 | Indole-Tacrine Heterodimer 5 | N-[5...)copy SMILEScopy InChI
Affinity DataIC50: 2.00E+3nMAssay Description:Inhibition of human AchE-induced amyloid beta aggregationMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAmine oxidase [flavin-containing] A(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM50231959(4-((prop-2-ynylamino)methyl)quinolin-8-ol | CHEMBL...)copy SMILEScopy InChI
Affinity DataIC50: 2.39E+3nMAssay Description:Inhibition of MAOAMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM10698(3-{[methyl(7-{[(2Z)-2-(1-naphthylmethylene)-3-oxo-...)copy SMILEScopy InChI
Affinity DataIC50: 2.76E+3nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

Curated by ChEMBL
LigandPNGBDBM10826(3-{2-[methyl(prop-2-yn-1-yl)amino]propyl}phenyl N-...)copy SMILEScopy InChI
Affinity DataIC50: 3.06E+3nMAssay Description:Inhibition of human AchEMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25B039WPubMed
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