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

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50137506   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Aryl hydrocarbon receptor (Homo sapiens (Human))	BDBM50137506 ((B(a)P) | 3,4-BP | 3,4-Benzopyrene | 3,4-Benzpyren...) Show SMILES c1ccc2c(c1)cc1ccc3cccc4ccc2c1c34 Show InChI InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Agonist activity at aryl hydrocarbon receptor in human MCF7 cells after 24 hrs CYP1A1-dependent EROD assay				Bioorg Med Chem 18: 1194-203 (2010) Article DOI: 10.1016/j.bmc.2009.12.036 BindingDB Entry DOI: 10.7270/Q2GX4BNF
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Homo sapiens (Human))	BDBM50137506 ((B(a)P) | 3,4-BP | 3,4-Benzopyrene | 3,4-Benzpyren...) Show SMILES c1ccc2c(c1)cc1ccc3cccc4ccc2c1c34 Show InChI InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	5	n/a	n/a	n/a	n/a
Kyushu University Curated by ChEMBL					Assay Description Concentration of the compound to bind to human AhR-modied electrode				Bioorg Med Chem Lett 14: 137-41 (2003) BindingDB Entry DOI: 10.7270/Q2WW7H2D
					More data for this Ligand-Target Pair