BDBM50249626 3-acetyl-2-(4-tert-butylphenylamino)-5,8-difluoroquinolin-4(1H)-one::CHEMBL491964

SMILES: CC(=O)c1c(Nc2ccc(cc2)C(C)(C)C)nc2c(F)ccc(F)c2c1O

InChI Key: InChIKey=SUVKDTBENLRJBS-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 = 50249626   

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))	BDBM50249626 (3-acetyl-2-(4-tert-butylphenylamino)-5,8-difluoroq...) Show SMILES CC(=O)c1c(Nc2ccc(cc2)C(C)(C)C)nc2c(F)ccc(F)c2c1O Show InChI InChI=1S/C21H20F2N2O2/c1-11(26)16-19(27)17-14(22)9-10-15(23)18(17)25-20(16)24-13-7-5-12(6-8-13)21(2,3)4/h5-10H,1-4H3,(H2,24,25,27)	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