BDBM50227400 (S)-3-methyl-N-(4-(methylamino)-3,4-dioxo-1-phenylbutan-2-yl)-4-oxo-1,4-dihydroquinoline-2-carboxamide::CHEMBL254948

SMILES: CNC(=O)C(=O)[C@H](Cc1ccccc1)NC(=O)c1nc2ccccc2c(O)c1C

InChI Key: InChIKey=GKMRRUCIKFBWMM-KRWDZBQOSA-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 = 50227400   

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))	BDBM50227400 ((S)-3-methyl-N-(4-(methylamino)-3,4-dioxo-1-phenyl...) Show SMILES CNC(=O)C(=O)[C@H](Cc1ccccc1)NC(=O)c1nc2ccccc2c(O)c1C Show InChI InChI=1S/C22H21N3O4/c1-13-18(24-16-11-7-6-10-15(16)19(13)26)21(28)25-17(20(27)22(29)23-2)12-14-8-4-3-5-9-14/h3-11,17H,12H2,1-2H3,(H,23,29)(H,24,26)(H,25,28)/t17-/m0/s1	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	8.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyung Hee University Curated by ChEMBL					Assay Description Inhibition of human mu-calpain				Bioorg Med Chem Lett 18: 205-9 (2008) Article DOI: 10.1016/j.bmcl.2007.10.097 BindingDB Entry DOI: 10.7270/Q2CV4HH3
					More data for this Ligand-Target Pair