BDBM50325329 4-((1H-imidazol-1-yl)methyl)phenyl 4-ethylbenzenesulfonate::CHEMBL1222850

SMILES: CCc1ccc(cc1)S(=O)(=O)Oc1ccc(Cn2ccnc2)cc1

InChI Key: InChIKey=JZJTZCFWEOWEKC-UHFFFAOYSA-N

Data: 2 IC50

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 = 50325329   

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 17A1 (Rattus norvegicus (Rat))	BDBM50325329 (4-((1H-imidazol-1-yl)methyl)phenyl 4-ethylbenzenes...) Show SMILES CCc1ccc(cc1)S(=O)(=O)Oc1ccc(Cn2ccnc2)cc1 Show InChI InChI=1S/C18H18N2O3S/c1-2-15-5-9-18(10-6-15)24(21,22)23-17-7-3-16(4-8-17)13-20-12-11-19-14-20/h3-12,14H,2,13H2,1H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
University of the West of Scotland Curated by ChEMBL					Assay Description Inhibition of 17,20-lyase activity of rat testicular microsomal P450-17alpha				Bioorg Med Chem Lett 20: 5345-8 (2010) Article DOI: 10.1016/j.bmcl.2010.02.100 BindingDB Entry DOI: 10.7270/Q2DF6RF1
					More data for this Ligand-Target Pair
Cytochrome P450 17A1 (Rattus norvegicus (Rat))	BDBM50325329 (4-((1H-imidazol-1-yl)methyl)phenyl 4-ethylbenzenes...) Show SMILES CCc1ccc(cc1)S(=O)(=O)Oc1ccc(Cn2ccnc2)cc1 Show InChI InChI=1S/C18H18N2O3S/c1-2-15-5-9-18(10-6-15)24(21,22)23-17-7-3-16(4-8-17)13-20-12-11-19-14-20/h3-12,14H,2,13H2,1H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
University of the West of Scotland Curated by ChEMBL					Assay Description Inhibition of 17alpha-hydroxylase activity of rat testicular microsomal P450-17alpha				Bioorg Med Chem Lett 20: 5345-8 (2010) Article DOI: 10.1016/j.bmcl.2010.02.100 BindingDB Entry DOI: 10.7270/Q2DF6RF1
					More data for this Ligand-Target Pair