BDBM50210349 CHEMBL3978020

SMILES: Brc1ccc2nc(NC(=O)c3cc4ccccc4[nH]3)sc2c1

InChI Key: InChIKey=MMOAXRSBNLJNFB-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 = 50210349   

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
Pyruvate kinase (Staphylococcus aureus (strain MRSA252))	BDBM50210349 (CHEMBL3978020) Show SMILES Brc1ccc2nc(NC(=O)c3cc4ccccc4[nH]3)sc2c1 Show InChI InChI=1S/C16H10BrN3OS/c17-10-5-6-12-14(8-10)22-16(19-12)20-15(21)13-7-9-3-1-2-4-11(9)18-13/h1-8,18H,(H,19,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Simon Fraser University Curated by ChEMBL					Assay Description Inhibition of recombinant N-terminal His-tagged methicillin-resistant Staphylococcus aureus MRSA252 pyruvate kinase expressed in Escherichia coli BL2...				Eur J Med Chem 125: 1-13 (2017) Article DOI: 10.1016/j.ejmech.2016.09.018 BindingDB Entry DOI: 10.7270/Q2CC12P0
					More data for this Ligand-Target Pair