BDBM50402620 CHEMBL2206168

SMILES: CC(=NNC(=O)c1ccc(Br)cc1O)c1cc2ccccc2[nH]1

InChI Key: InChIKey=FAYVUBWXRWAFBL-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 = 50402620   

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))	BDBM50402620 (CHEMBL2206168) Show SMILES CC(=NNC(=O)c1ccc(Br)cc1O)c1cc2ccccc2[nH]1 |w:2.2| Show InChI InChI=1S/C17H14BrN3O2/c1-10(15-8-11-4-2-3-5-14(11)19-15)20-21-17(23)13-7-6-12(18)9-16(13)22/h2-9,19,22H,1H3,(H,21,23)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
Simon Fraser University Curated by ChEMBL					Assay Description Inhibition of methicillin-resistant Staphylococcus aureus 252 pyruvate kinase by LDH assay				Bioorg Med Chem 20: 7069-82 (2012) Article DOI: 10.1016/j.bmc.2012.10.002 BindingDB Entry DOI: 10.7270/Q2NZ88ST
					More data for this Ligand-Target Pair