BDBM50443208 CHEMBL3087355

SMILES: Clc1cc(Cl)cc(c1)S(=O)(=O)Nc1ccc(cc1)-c1ccncc1

InChI Key: InChIKey=BZUSMKVXJJRSBP-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50443208   

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 2D6 (Homo sapiens (Human))	BDBM50443208 (CHEMBL3087355) Show SMILES Clc1cc(Cl)cc(c1)S(=O)(=O)Nc1ccc(cc1)-c1ccncc1 Show InChI InChI=1S/C17H12Cl2N2O2S/c18-14-9-15(19)11-17(10-14)24(22,23)21-16-3-1-12(2-4-16)13-5-7-20-8-6-13/h1-11,21H	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of CYP2D6 (unknown origin) after 10 mins				Bioorg Med Chem Lett 23: 6447-54 (2013) Article DOI: 10.1016/j.bmcl.2013.09.041 BindingDB Entry DOI: 10.7270/Q2C53N9S
					More data for this Ligand-Target Pair