BDBM50239239 CHEMBL4076097

SMILES: NS(=O)(=O)Nc1cncc(c1)-c1nc(NCc2ccccn2)c2c(cccc2n1)-c1ccccc1

InChI Key: InChIKey=GPYUSYNKDNQBNE-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 = 50239239   

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
1,3-beta-glucan synthase component GLS2 (Saccharomyces cerevisiae)	BDBM50239239 (CHEMBL4076097) Show SMILES NS(=O)(=O)Nc1cncc(c1)-c1nc(NCc2ccccn2)c2c(cccc2n1)-c1ccccc1 Show InChI InChI=1S/C25H21N7O2S/c26-35(33,34)32-20-13-18(14-27-15-20)24-30-22-11-6-10-21(17-7-2-1-3-8-17)23(22)25(31-24)29-16-19-9-4-5-12-28-19/h1-15,32H,16H2,(H2,26,33,34)(H,29,30,31)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Inhibition of human ERG expressed in HEK293 cells by patch clamp method				J Med Chem 60: 3795-3803 (2017) Article DOI: 10.1021/acs.jmedchem.6b01889 BindingDB Entry DOI: 10.7270/Q24J0H85
					More data for this Ligand-Target Pair