BDBM50029038 CHEMBL3339199

SMILES: Cc1ccc2[nH]cc(CCc3c[nH]c4ccccc34)c2c1

InChI Key: InChIKey=WTLNTAOAOGCUFP-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 = 50029038   

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))	BDBM50029038 (CHEMBL3339199) Show SMILES Cc1ccc2[nH]cc(CCc3c[nH]c4ccccc34)c2c1 Show InChI InChI=1S/C19H18N2/c1-13-6-9-19-17(10-13)15(12-21-19)8-7-14-11-20-18-5-3-2-4-16(14)18/h2-6,9-12,20-21H,7-8H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.28E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of purified methicillin-resistant Staphylococcus aureus N-terminal His-tagged pyruvate kinase by LDH-coupled continuous assay				Bioorg Med Chem Lett 24: 5059-62 (2014) Article DOI: 10.1016/j.bmcl.2014.09.010 BindingDB Entry DOI: 10.7270/Q24J0GQK
					More data for this Ligand-Target Pair