BDBM50110027 1-[2,3-dimethyl-4-(2,4,5-trimethoxyphenyl)-(1R,2R,3R,4R)-cyclobutyl]-2,4,5-trimethoxybenzene::CHEMBL156339::MAGNOSALIN

SMILES COc1cc(OC)c(cc1OC)[C@@H]1[C@H](C)[C@@H](C)[C@H]1c1cc(OC)c(OC)cc1OC

InChI Key InChIKey=WCERJEZPIONOJU-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 = 50110027   

TargetCytochrome P450 3A4(Human)
Toyama Medical and Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50110027(CHEMBL156339 | 1-[2,3-dimethyl-4-(2,4,5-trimethoxy...)
Affinity DataIC50: 8.54E+4nMAssay Description:Inhibition of human liver microsome CYP3A4 in assessed as [14C]formaldehyde formationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2012
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Toyama Medical and Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50110027(CHEMBL156339 | 1-[2,3-dimethyl-4-(2,4,5-trimethoxy...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human liver microsome CYP2D6 in assessed as [14C]formaldehyde formationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2012
Entry Details Article
PubMed