BDBM8933 (2E)-2-(1H-imidazol-5-ylmethylidene)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-one::6-methoxy-2-(1H-imidazol-5-ylmethylene)-3,4-dihydro-2H-naphthalen-1-one::GW93

SMILES: COc1ccc2C(=O)C(CCc2c1)=Cc1cnc[nH]1

InChI Key: InChIKey=SJDRKSLIRYRHDO-UHFFFAOYSA-N

Data: 1 IC50  1 Other

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 = 8933   

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
Cytochrome P450 19A1 (Homo sapiens (Human))	BDBM8933 ((2E)-2-(1H-imidazol-5-ylmethylidene)-6-methoxy-1,2...) Show SMILES COc1ccc2C(=O)C(CCc2c1)=Cc1cnc[nH]1 |w:13.15| Show InChI InChI=1S/C15H14N2O2/c1-19-13-4-5-14-10(7-13)2-3-11(15(14)18)6-12-8-16-9-17-12/h4-9H,2-3H2,1H3,(H,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Saarland University					Assay Description The enzyme activity was assayed by measuring the 3H-labeled H2O formed from [1beta-3H]androstenedione during aromatization. After incubation, the rea...				J Enzyme Inhib Med Chem 19: 17-32 (2004) Article DOI: 10.1080/14756360310001640913 BindingDB Entry DOI: 10.7270/Q2CF9N9T
					More data for this Ligand-Target Pair
Cytochrome P450 17A1 (Homo sapiens (Human))	BDBM8933 ((2E)-2-(1H-imidazol-5-ylmethylidene)-6-methoxy-1,2...) Show SMILES COc1ccc2C(=O)C(CCc2c1)=Cc1cnc[nH]1 |w:13.15| Show InChI InChI=1S/C15H14N2O2/c1-19-13-4-5-14-10(7-13)2-3-11(15(14)18)6-12-8-16-9-17-12/h4-9H,2-3H2,1H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	n/a	n/a	n/a	7.4	37
Saarland University					Assay Description The 17 alpha-hydroxylase activity of CYP 17 was determined by measuring the conversion of progesterone into 17 alpha-hydroxyprogesterone and the bypr...				J Enzyme Inhib Med Chem 19: 17-32 (2004) Article DOI: 10.1080/14756360310001640913 BindingDB Entry DOI: 10.7270/Q2CF9N9T
					More data for this Ligand-Target Pair