BDBM50609918 CHEMBL5290552

SMILES [#6]-[#6]-[#6]\[#6](=[#6]/[#6]-[#8]-c1c2occc2c(-[#6])c2ccc(=O)oc12)\[#6]=[#6](\[#6])-[#6]

InChI Key InChIKey=NSHJJKQWXUZZRL-UHFFFAOYSA-N

Data  1 KI

  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 = 50609918   

TargetCytochrome P450 1A1(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50609918BDBM50609918(CHEMBL5290552)
Affinity DataKi:  7.17E+3nMAssay Description:Inhibition of CYP1A1 (unknown origin) assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/20/2024
Entry Details
PubMed