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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 2C9' and Monomerid = 50218035   
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
Cytochrome P450 2C9


(Homo sapiens (human))
BDBM50218035
PNG
(8-fluoro-4-methyl-6-((4-(2-(2-methylquinolin-5-ylo...)
Show SMILES CN1C(=O)COc2c(F)cc(CN3CCN(CCOc4cccc5nc(C)ccc45)CC3)cc12
Show InChI InChI=1S/C26H29FN4O3/c1-18-6-7-20-22(28-18)4-3-5-24(20)33-13-12-30-8-10-31(11-9-30)16-19-14-21(27)26-23(15-19)29(2)25(32)17-34-26/h3-7,14-15H,8-13,16-17H2,1-2H3
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Similars

Article
PubMed
n/an/a>1.90E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of CYP2C9


Bioorg Med Chem Lett 17: 5214-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.078
BindingDB Entry DOI: 10.7270/Q24J0DT3
More data for this
Ligand-Target Pair