BDBM21160 N-[(5-methylpyrimidin-2-yl)methyl]-6-phenyl-2-(pyridin-4-yl)pyrimidin-4-amine::Pyridine-based ligand, 11

SMILES Cc1cnc(CNc2cc(nc(n2)-c2ccncc2)-c2ccccc2)nc1

InChI Key InChIKey=XCYJXGREMGRASS-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 21160   

TargetCytochrome P450 2C9(Homo sapiens (Human))
Astrazeneca

LigandPNGBDBM21160(N-[(5-methylpyrimidin-2-yl)methyl]-6-phenyl-2-(pyr...)
Affinity DataIC50:  4.80E+3nMAssay Description:The inhibition of recombinant human CYP2C9 was measured as the ability to perform a demethylation of 7-methoxy-4-trifluoromethylcoumarin (MFC). Befor...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Astrazeneca

LigandPNGBDBM21160(N-[(5-methylpyrimidin-2-yl)methyl]-6-phenyl-2-(pyr...)
Affinity DataIC50:  71nMpH: 7.4 T: 2°CAssay Description:The inhibition of recombinant human CYP3A4 was measured as the ability to perform a debenzylation of 7-benzyloxy-4-trifluoromethylcoumarin (BFC). Bef...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed