BDBM50286438 1-(4-Hydroxy-2-trifluoromethyl-phenyl)-4-oxo-7-pyridin-4-yl-1,4-dihydro-quinoline-3-carboxylic acid amide::CHEMBL339558

SMILES: NC(=O)c1cn(-c2ccc(O)cc2C(F)(F)F)c2cc(ccc2c1=O)-c1ccncc1

InChI Key: InChIKey=CLAWODBMLZUDJL-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 = 50286438   

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))	BDBM50286438 (1-(4-Hydroxy-2-trifluoromethyl-phenyl)-4-oxo-7-pyr...) Show SMILES NC(=O)c1cn(-c2ccc(O)cc2C(F)(F)F)c2cc(ccc2c1=O)-c1ccncc1 Show InChI InChI=1S/C22H14F3N3O3/c23-22(24,25)17-10-14(29)2-4-18(17)28-11-16(21(26)31)20(30)15-3-1-13(9-19(15)28)12-5-7-27-8-6-12/h1-11,29H,(H2,26,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against human erythrocyte Calpain 1				Bioorg Med Chem Lett 5: 387-392 (1995) Article DOI: 10.1016/0960-894X(95)00041-Q BindingDB Entry DOI: 10.7270/Q21G0M6W
					More data for this Ligand-Target Pair