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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanin-concentrating hormone receptor 1' and Ligand = 'BDBM50199227'   
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
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50199227
PNG
(6-(4-chlorophenyl)-3-[2-[(dimethylamino)methyl]-4-...)
Show SMILES CN(C)CC1CN(c2cc(ccc2O1)-n1cnc2cc(sc2c1=O)-c1ccc(Cl)cc1)S(C)(=O)=O
Show InChI InChI=1S/C24H23ClN4O4S2/c1-27(2)12-18-13-29(35(3,31)32)20-10-17(8-9-21(20)33-18)28-14-26-19-11-22(34-23(19)24(28)30)15-4-6-16(25)7-5-15/h4-11,14,18H,12-13H2,1-3H3
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Similars

Article
PubMed
n/an/a 4.17E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity against human MCHR1 expressed in CHO cells by Gal4/Elk1-Luc reporter assay


J Med Chem 49: 7095-107 (2006)


Article DOI: 10.1021/jm060572f
BindingDB Entry DOI: 10.7270/Q2P26XS8
More data for this
Ligand-Target Pair