BDBM50124848 2-[3-(8-Bromo-6-methyl-1,2,3,4-tetrahydro-quinolin-4-ylamino)-propylamino]-1H-quinolin-4-one::CHEMBL161213

SMILES: Cc1cc(Br)c2NCCC(NCCCNc3cc(O)c4ccccc4n3)c2c1

InChI Key: InChIKey=ZPSIVYGZEXJFJH-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 = 50124848   

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
Methionyl-tRNA synthetase (Escherichia coli (strain K12))	BDBM50124848 (2-[3-(8-Bromo-6-methyl-1,2,3,4-tetrahydro-quinolin...) Show SMILES Cc1cc(Br)c2NCCC(NCCCNc3cc(O)c4ccccc4n3)c2c1 Show InChI InChI=1S/C22H25BrN4O/c1-14-11-16-18(7-10-26-22(16)17(23)12-14)24-8-4-9-25-21-13-20(28)15-5-2-3-6-19(15)27-21/h2-3,5-6,11-13,18,24,26H,4,7-10H2,1H3,(H2,25,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Compound tested for inhibition of Staphylococcus aureus MRS (methionyl tRNA synthetase) in aminoacylation assay				Bioorg Med Chem Lett 13: 665-8 (2003) BindingDB Entry DOI: 10.7270/Q2KP81JD
					More data for this Ligand-Target Pair