BDBM50249608 3-acetyl-8-chloro-5-nitro-2-(m-tolylamino)quinolin-4(1H)-one::CHEMBL512192

SMILES: CC(=O)c1c(Nc2cccc(C)c2)nc2c(Cl)ccc([N+]([O-])=O)c2c1O

InChI Key: InChIKey=CUBCGVOLNPCKPK-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 = 50249608   

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
Calpain1 (Homo sapiens (Human))	BDBM50249608 (3-acetyl-8-chloro-5-nitro-2-(m-tolylamino)quinolin...) Show SMILES CC(=O)c1c(Nc2cccc(C)c2)nc2c(Cl)ccc([N+]([O-])=O)c2c1O Show InChI InChI=1S/C18H14ClN3O4/c1-9-4-3-5-11(8-9)20-18-14(10(2)23)17(24)15-13(22(25)26)7-6-12(19)16(15)21-18/h3-8H,1-2H3,(H2,20,21,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Ewha Womans University Curated by ChEMBL					Assay Description Inhibition of human erythrocytes mu-calpain after 30 mins by fluorometric assay using pep1 as substrate				J Med Chem 52: 3093-7 (2009) Article DOI: 10.1021/jm8014734 BindingDB Entry DOI: 10.7270/Q2KK9CQ4
					More data for this Ligand-Target Pair