BDBM9911 3-Phenyl-7-(4-biphenylmethoxy)-2-[(4-pyridylmethyl)thio]-4H-1-benzopyran-4-one::3-phenyl-7-[(4-phenylphenyl)methoxy]-2-[(pyridin-4-ylmethyl)sulfanyl]-4H-chromen-4-one::isoflavone deriv. 5m

SMILES O=c1c(-c2ccccc2)c(SCc2ccncc2)oc2cc(OCc3ccc(cc3)-c3ccccc3)ccc12

InChI Key InChIKey=ZUCARDAJOVLPMS-UHFFFAOYSA-N

Data  1 KI  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 = 9911   

TargetAromatase(Human)
Johns Hopkins University

Curated by ChEMBL
LigandPNGBDBM9911(3-phenyl-7-[(4-phenylphenyl)methoxy]-2-[(pyridin-4...)
Affinity DataIC50: 85nMAssay Description:Inhibition of human placental microsome CYP19More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAromatase(Human)
Johns Hopkins University

Curated by ChEMBL
LigandPNGBDBM9911(3-phenyl-7-[(4-phenylphenyl)methoxy]-2-[(pyridin-4...)
Affinity DataKi:  39nM ΔG°:  -10.5kcal/mole IC50: 79nMpH: 7.0 T: 2°CAssay Description:Inhibition of human placental aromatase was determined by monitoring the amount of 3H2O released as the enzyme converts [1beta-3H]androst-4-ene-3,17-...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed