BDBM50310825 6',7'-Dihydroxybergamottin Decanal Acetal::CHEMBL1078190

SMILES CCCCCCCCCC1O[C@H](CC\C(C)=C\COc2c3ccoc3cc3oc(=O)ccc23)C(C)(C)O1

InChI Key InChIKey=GAAPAEWIPWJVMW-AYBMPSMDSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50310825   

TargetCytochrome P450 3A4(Homo sapiens (Human))
University Of Sao Paulo State

Curated by ChEMBL
LigandPNGBDBM50310825(6',7'-Dihydroxybergamottin Decanal Acetal | CHEMBL...)
Affinity DataIC50:  270nMAssay Description:Inhibition of CYP3A4 after 30 mins by fluorescence microplate reader assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed