BDBM21153 Isoxazole-based ligand, 4::ethyl 3-(2,4-dichlorophenyl)-2-(1,2-oxazol-5-yl)propanoate

SMILES CCOC(=O)C(Cc1ccc(Cl)cc1Cl)c1ccno1

InChI Key InChIKey=AXKQUNLOEFWORV-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 21153   

TargetCytochrome P450 3A4(Human)
Astrazeneca

LigandPNGBDBM21153(ethyl 3-(2,4-dichlorophenyl)-2-(1,2-oxazol-5-yl)pr...)
Affinity DataIC50: 1.20E+4nMpH: 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

LigandPNGBDBM21153(ethyl 3-(2,4-dichlorophenyl)-2-(1,2-oxazol-5-yl)pr...)
Affinity DataIC50: 1.10E+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