Found 18 hits Enz. Inhib. hit(s) with all data for entry = 50013644 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50132844
(4-[3-(2-Diethylamino-ethyl)-5-methoxy-indole-1-sul...)Show SMILES CCN(CC)CCc1cn(c2ccc(OC)cc12)S(=O)(=O)c1ccc(N)cc1 Show InChI InChI=1S/C21H27N3O3S/c1-4-23(5-2)13-12-16-15-24(21-11-8-18(27-3)14-20(16)21)28(25,26)19-9-6-17(22)7-10-19/h6-11,14-15H,4-5,12-13,22H2,1-3H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50132848
(4-[3-(2-Diethylamino-ethyl)-indole-1-sulfonyl]-phe...)Show SMILES CCN(CC)CCc1cn(c2ccccc12)S(=O)(=O)c1ccc(N)cc1 Show InChI InChI=1S/C20H25N3O2S/c1-3-22(4-2)14-13-16-15-23(20-8-6-5-7-19(16)20)26(24,25)18-11-9-17(21)10-12-18/h5-12,15H,3-4,13-14,21H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50130275
(4-(3-(2-(dimethylamino)ethyl)-1H-indol-1-ylsulfony...)Show InChI InChI=1S/C18H21N3O2S/c1-20(2)12-11-14-13-21(18-6-4-3-5-17(14)18)24(22,23)16-9-7-15(19)8-10-16/h3-10,13H,11-12,19H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50130263
(4-[3-(2-Dimethylamino-ethyl)-5-methoxy-indole-1-su...)Show SMILES COc1ccc2n(cc(CCN(C)C)c2c1)S(=O)(=O)c1ccc(N)cc1 Show InChI InChI=1S/C19H23N3O3S/c1-21(2)11-10-14-13-22(19-9-6-16(25-3)12-18(14)19)26(23,24)17-7-4-15(20)5-8-17/h4-9,12-13H,10-11,20H2,1-3H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM34141
(CHEMBL76237 | MS-245)Show SMILES COc1ccc2n(cc(CCN(C)C)c2c1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C19H22N2O3S/c1-20(2)12-11-15-14-21(19-10-9-16(24-3)13-18(15)19)25(22,23)17-7-5-4-6-8-17/h4-10,13-14H,11-12H2,1-3H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 2.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50132847
(4-{3-[2-(Benzyl-methyl-amino)-ethyl]-5-methoxy-ind...)Show SMILES COc1ccc2n(cc(CCN(C)Cc3ccccc3)c2c1)S(=O)(=O)c1ccc(N)cc1 Show InChI InChI=1S/C25H27N3O3S/c1-27(17-19-6-4-3-5-7-19)15-14-20-18-28(25-13-10-22(31-2)16-24(20)25)32(29,30)23-11-8-21(26)9-12-23/h3-13,16,18H,14-15,17,26H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM34149
(CHEMBL94422 | N-benzenesulfonylgramine antagonist,...)Show InChI InChI=1S/C17H18N2O2S/c1-18(2)12-14-13-19(17-11-7-6-10-16(14)17)22(20,21)15-8-4-3-5-9-15/h3-11,13H,12H2,1-2H3 | PDB
Reactome pathway
KEGG
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| CHEMBL
PC cid
PC sid
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Similars
| PubMed
| 3.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50106250
(CHEMBL93868 | N,N-dimethyl-2-(1-(phenylsulfonyl)-1...)Show InChI InChI=1S/C18H20N2O2S/c1-19(2)13-12-15-14-20(18-11-7-6-10-17(15)18)23(21,22)16-8-4-3-5-9-16/h3-11,14H,12-13H2,1-2H3 | PDB
Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 4.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50132843
(CHEMBL333373 | [2-(1-Benzenesulfonyl-5-methoxy-1H-...)Show SMILES CCN(CC)CCc1cn(c2ccc(OC)cc12)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C21H26N2O3S/c1-4-22(5-2)14-13-17-16-23(21-12-11-18(26-3)15-20(17)21)27(24,25)19-9-7-6-8-10-19/h6-12,15-16H,4-5,13-14H2,1-3H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 6.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50130283
(4-(3-Dimethylaminomethyl-indole-1-sulfonyl)-phenyl...)Show InChI InChI=1S/C17H19N3O2S/c1-19(2)11-13-12-20(17-6-4-3-5-16(13)17)23(21,22)15-9-7-14(18)8-10-15/h3-10,12H,11,18H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 6.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM34150
(4-(3-methyl-1H-indole-1-sulfonyl)aniline, 8 | CHEM...)Show InChI InChI=1S/C15H14N2O2S/c1-11-10-17(15-5-3-2-4-14(11)15)20(18,19)13-8-6-12(16)7-9-13/h2-10H,16H2,1H3 | PDB
Reactome pathway
KEGG
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PC sid
UniChem
Similars
| PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50132845
(CHEMBL111943 | [2-(1-Benzenesulfonyl-5-methoxy-1H-...)Show InChI InChI=1S/C18H20N2O3S/c1-19-11-10-14-13-20(18-9-8-15(23-2)12-17(14)18)24(21,22)16-6-4-3-5-7-16/h3-9,12-13,19H,10-11H2,1-2H3 | PDB
Reactome pathway
KEGG
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| CHEMBL
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PC sid
UniChem
Similars
| PubMed
| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50132840
(CHEMBL324766 | N-{4-[3-(2-Dimethylamino-ethyl)-ind...)Show SMILES CN(C)CCc1cn(c2ccccc12)S(=O)(=O)c1ccc(NC(C)=O)cc1 Show InChI InChI=1S/C20H23N3O3S/c1-15(24)21-17-8-10-18(11-9-17)27(25,26)23-14-16(12-13-22(2)3)19-6-4-5-7-20(19)23/h4-11,14H,12-13H2,1-3H3,(H,21,24) | PDB
Reactome pathway
KEGG
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PC sid
UniChem
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| 27 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50106254
(1-Benzenesulfonyl-3-(2-dimethylamino-ethyl)-1H-ind...)Show InChI InChI=1S/C18H20N2O3S/c1-19(2)11-10-14-13-20(18-9-8-15(21)12-17(14)18)24(22,23)16-6-4-3-5-7-16/h3-9,12-13,21H,10-11H2,1-2H3 | PDB
Reactome pathway
KEGG
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PC sid
UniChem
Similars
| PubMed
| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50132842
(CHEMBL419398 | N-{4-[3-(2-Dimethylamino-ethyl)-5-m...)Show SMILES COc1ccc2n(cc(CCN(C)C)c2c1)S(=O)(=O)c1ccc(NC(C)=O)cc1 Show InChI InChI=1S/C21H25N3O4S/c1-15(25)22-17-5-8-19(9-6-17)29(26,27)24-14-16(11-12-23(2)3)20-13-18(28-4)7-10-21(20)24/h5-10,13-14H,11-12H2,1-4H3,(H,22,25) | PDB
Reactome pathway
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 34 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50132849
(CHEMBL112285 | [2-(1-Benzenesulfonyl-5-methoxy-1H-...)Show SMILES COc1ccc2n(cc(CCN(C)Cc3ccccc3)c2c1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C25H26N2O3S/c1-26(18-20-9-5-3-6-10-20)16-15-21-19-27(25-14-13-22(30-2)17-24(21)25)31(28,29)23-11-7-4-8-12-23/h3-14,17,19H,15-16,18H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 43 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50132846
(CHEMBL322980 | N-{4-[3-(2-Diethylamino-ethyl)-indo...)Show SMILES CCN(CC)CCc1cn(c2ccccc12)S(=O)(=O)c1ccc(NC(C)=O)cc1 Show InChI InChI=1S/C22H27N3O3S/c1-4-24(5-2)15-14-18-16-25(22-9-7-6-8-21(18)22)29(27,28)20-12-10-19(11-13-20)23-17(3)26/h6-13,16H,4-5,14-15H2,1-3H3,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 6
(Homo sapiens (Human)) | BDBM50132841
(CHEMBL325428 | N-{4-[3-(2-Diethylamino-ethyl)-5-me...)Show SMILES CCN(CC)CCc1cn(c2ccc(OC)cc12)S(=O)(=O)c1ccc(NC(C)=O)cc1 Show InChI InChI=1S/C23H29N3O4S/c1-5-25(6-2)14-13-18-16-26(23-12-9-20(30-4)15-22(18)23)31(28,29)21-10-7-19(8-11-21)24-17(3)27/h7-12,15-16H,5-6,13-14H2,1-4H3,(H,24,27) | PDB
Reactome pathway
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AffyNet
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PC cid
PC sid
UniChem
Similars
| PubMed
| 230 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Virginia Commonwealth University
Curated by ChEMBL
| Assay Description
Binding affinity towards human 5-hydroxytryptamine 6 receptor |
Bioorg Med Chem Lett 13: 3355-9 (2003)
BindingDB Entry DOI: 10.7270/Q2DN44GB |
More data for this
Ligand-Target Pair | |
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