BDBM21168 Imidazole-based ligand, 19::methyl (2S)-2-(benzylamino)-3-(1H-imidazol-4-yl)propanoate

SMILES COC(=O)[C@H](Cc1cnc[nH]1)NCc1ccccc1

InChI Key InChIKey=ZVJJJFLRYHVRLN-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 = 21168   

TargetCytochrome P450 3A4(Human)
Astrazeneca

LigandPNGBDBM21168(methyl (2S)-2-(benzylamino)-3-(1H-imidazol-4-yl)pr...)
Affinity DataIC50: 1.50E+3nMpH: 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 Depth
Date in BDB:
4/7/2008
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Astrazeneca

LigandPNGBDBM21168(methyl (2S)-2-(benzylamino)-3-(1H-imidazol-4-yl)pr...)
Affinity DataIC50: 2.00E+4nMAssay 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 Depth
Date in BDB:
4/7/2008
Entry Details Article
PubMed