BDBM50443211 CHEMBL3087351

SMILES: Clc1cc(Cl)cc(c1)S(=O)(=O)Nc1ccc(cc1)-c1cc[nH]n1

InChI Key: InChIKey=VTPLTXZKMKTFBQ-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 = 50443211   

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))	BDBM50443211 (CHEMBL3087351) Show SMILES Clc1cc(Cl)cc(c1)S(=O)(=O)Nc1ccc(cc1)-c1cc[nH]n1 Show InChI InChI=1S/C15H11Cl2N3O2S/c16-11-7-12(17)9-14(8-11)23(21,22)20-13-3-1-10(2-4-13)15-5-6-18-19-15/h1-9,20H,(H,18,19)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.18E+4	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