BDBM50394086 CHEMBL2158564

SMILES: CCN(CC)CCSc1nc(-c2cc(OC)c(cc2Cl)C#N)c2c(c[nH]c2n1)C#N

InChI Key: InChIKey=HKUOVWSDWHZGOB-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 = 50394086   

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
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50394086 (CHEMBL2158564) Show SMILES CCN(CC)CCSc1nc(-c2cc(OC)c(cc2Cl)C#N)c2c(c[nH]c2n1)C#N Show InChI InChI=1S/C21H21ClN6OS/c1-4-28(5-2)6-7-30-21-26-19(18-14(11-24)12-25-20(18)27-21)15-9-17(29-3)13(10-23)8-16(15)22/h8-9,12H,4-7H2,1-3H3,(H,25,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
Vernalis Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-dofetilide from human ERG				Bioorg Med Chem 20: 6770-89 (2012) Article DOI: 10.1016/j.bmc.2012.08.050 BindingDB Entry DOI: 10.7270/Q2KS6SN4
					More data for this Ligand-Target Pair