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2 similar compounds to monomer 50187074

Compile data set for download or QSAR
Wt: 355.4
BDBM50187075
Wt: 326.4
BDBM50203139

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50187075,50203139   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (Human))
BDBM50203139
PNG
(4-(1,2,3,4-Tetrahydro-carbazole-9-sulfonyl)-phenyl...)
Show SMILES Nc1ccc(cc1)S(=O)(=O)n1c2CCCCc2c2ccccc12
Show InChI InChI=1S/C18H18N2O2S/c19-13-9-11-14(12-10-13)23(21,22)20-17-7-3-1-5-15(17)16-6-2-4-8-18(16)20/h1,3,5,7,9-12H,2,4,6,8,19H2
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Article
PubMed
29n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Displacement of [3H] LSD from human 5HT6 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 17: 1691-4 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.089
BindingDB Entry DOI: 10.7270/Q2V69J82
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (Human))
BDBM50203139
PNG
(4-(1,2,3,4-Tetrahydro-carbazole-9-sulfonyl)-phenyl...)
Show SMILES Nc1ccc(cc1)S(=O)(=O)n1c2CCCCc2c2ccccc12
Show InChI InChI=1S/C18H18N2O2S/c19-13-9-11-14(12-10-13)23(21,22)20-17-7-3-1-5-15(17)16-6-2-4-8-18(16)20/h1,3,5,7,9-12H,2,4,6,8,19H2
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Article
PubMed
32n/an/an/an/an/an/an/an/a



Universidad Complutense

Curated by ChEMBL


Assay Description
Binding affinity for human 5-hydroxytryptamine 6 receptor


J Med Chem 48: 4216-9 (2005)

Checked by Author
Article DOI: 10.1021/jm050247c
BindingDB Entry DOI: 10.7270/Q2736SD0
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (Human))
BDBM50187075
PNG
(9-(4-aminophenylsulfonyl)-N-methyl-6,7,8,9-tetrahy...)
Show SMILES CNc1ccc2c3CCCCc3n(c2c1)S(=O)(=O)c1ccc(N)cc1
Show InChI InChI=1S/C19H21N3O2S/c1-21-14-8-11-17-16-4-2-3-5-18(16)22(19(17)12-14)25(23,24)15-9-6-13(20)7-10-15/h6-12,21H,2-5,20H2,1H3
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Article
PubMed
205n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT6 receptor


Bioorg Med Chem Lett 16: 3793-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.094
BindingDB Entry DOI: 10.7270/Q2H70FDF
More data for this
Ligand-Target Pair