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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 = 'BDBM50193471'   
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))
BDBM50193471
PNG
(CHEMBL378892 | N,N-dimethyl-2-(1-(phenylsulfonyl)-...)
Show SMILES CN(C)CCc1ccn(c1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C14H18N2O2S/c1-15(2)10-8-13-9-11-16(12-13)19(17,18)14-6-4-3-5-7-14/h3-7,9,11-12H,8,10H2,1-2H3
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
15n/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


J Med Chem 51: 603-11 (2008)


Article DOI: 10.1021/jm070910s
BindingDB Entry DOI: 10.7270/Q2CJ8D84
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50193471
PNG
(CHEMBL378892 | N,N-dimethyl-2-(1-(phenylsulfonyl)-...)
Show SMILES CN(C)CCc1ccn(c1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C14H18N2O2S/c1-15(2)10-8-13-9-11-16(12-13)19(17,18)14-6-4-3-5-7-14/h3-7,9,11-12H,8,10H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
15n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity to human 5HT6 receptor in HEK293 cells by radioligand binding assay


J Med Chem 49: 5217-25 (2006)


Article DOI: 10.1021/jm060469q
BindingDB Entry DOI: 10.7270/Q2416WQN
More data for this
Ligand-Target Pair