BDBM50101976 ASARININ::Episesamin

SMILES [H][C@]12CO[C@H](c3ccc4OCOc4c3)[C@@]1([H])CO[C@H]2c1ccc2OCOc2c1

InChI Key InChIKey=PEYUIKBAABKQKQ-WZBLMQSHSA-N

Data  1 KI

  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 1 hit for monomerid = 50101976   

TargetCytochrome P450 2C9(Homo sapiens (Human))
Toyama Prefectural University

Curated by ChEMBL
LigandPNGBDBM50101976(ASARININ | Episesamin)
Affinity DataKi:  6.80E+3nMAssay Description:Mechanism-based inhibition of recombinant human CYP2C9 expressed in microsomes isolated from Saccharomyces cerevisiae AH22 cells assessed as diclofen...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed