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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 6' and Ligand = 'BDBM50251729'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50251729
PNG
(6-(2-methoxyphenylsulfonyl)-1,2,3,4,5,6-hexahydroa...)
Show SMILES COc1ccccc1S(=O)(=O)n1c2CCNCCc2c2ccccc12
Show InChI InChI=1S/C19H20N2O3S/c1-24-18-8-4-5-9-19(18)25(22,23)21-16-7-3-2-6-14(16)15-10-12-20-13-11-17(15)21/h2-9,20H,10-13H2,1H3
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PC cid
PC sid
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Similars

Article
PubMed
19n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


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


Bioorg Med Chem Lett 18: 3929-31 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.030
BindingDB Entry DOI: 10.7270/Q2959HCP
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50251729
PNG
(6-(2-methoxyphenylsulfonyl)-1,2,3,4,5,6-hexahydroa...)
Show SMILES COc1ccccc1S(=O)(=O)n1c2CCNCCc2c2ccccc12
Show InChI InChI=1S/C19H20N2O3S/c1-24-18-8-4-5-9-19(18)25(22,23)21-16-7-3-2-6-14(16)15-10-12-20-13-11-17(15)21/h2-9,20H,10-13H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 162n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Antagonist activity at cloned human 5HT6 receptor expressed in HeLa cells assessed as production of cAMP


Bioorg Med Chem Lett 18: 3929-31 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.030
BindingDB Entry DOI: 10.7270/Q2959HCP
More data for this
Ligand-Target Pair