BDBM50137506 (B(a)P)::3,4-BP::3,4-Benzopyrene::3,4-Benzpyrene::Benzo(a)pyrene::CHEMBL31184::benzo[a]pyrene::benzo[def]chrysene::benzo[pqr]tetraphene

SMILES c1ccc2c(c1)cc1ccc3cccc4ccc2c1c34

InChI Key InChIKey=FMMWHPNWAFZXNH-UHFFFAOYSA-N

Data  2 EC50

PDB links: 1 PDB ID matches this monomer.

  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 2 hits for monomerid = 50137506   

TargetAryl hydrocarbon receptor(Homo sapiens (Human))
The University Of Tokyo

Curated by ChEMBL
LigandPNGBDBM50137506((B(a)P) | 3,4-BP | 3,4-Benzopyrene | 3,4-Benzpyren...)
Affinity DataEC50:  2.70E+3nMAssay Description:Agonist activity at aryl hydrocarbon receptor in human MCF7 cells after 24 hrs CYP1A1-dependent EROD assayMore data for this Ligand-Target Pair
TargetAryl hydrocarbon receptor(Homo sapiens (Human))
The University Of Tokyo

Curated by ChEMBL
LigandPNGBDBM50137506((B(a)P) | 3,4-BP | 3,4-Benzopyrene | 3,4-Benzpyren...)
Affinity DataEC50:  5nMAssay Description:Concentration of the compound to bind to human AhR-modied electrodeMore data for this Ligand-Target Pair