BDBM50396570 CHEMBL2171384

SMILES: OC(=O)C[C@H](NC(=O)c1cc(=O)n([nH]1)-c1ccccc1F)c1ccccc1C(F)(F)F

InChI Key: InChIKey=YXWWGITXGQDYPS-AWEZNQCLSA-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 = 50396570   

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
Cathepsin A (CTSA) (Homo sapiens (Human))	BDBM50396570 (CHEMBL2171384) Show SMILES OC(=O)C[C@H](NC(=O)c1cc(=O)n([nH]1)-c1ccccc1F)c1ccccc1C(F)(F)F |r| Show InChI InChI=1S/C20H15F4N3O4/c21-13-7-3-4-8-16(13)27-17(28)9-15(26-27)19(31)25-14(10-18(29)30)11-5-1-2-6-12(11)20(22,23)24/h1-9,14,26H,10H2,(H,25,31)(H,29,30)/t14-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	375	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Deutschland GmbH Curated by ChEMBL					Assay Description Inhibition of human recombinant Myc-His10-tagged cathepsin A expressed in baculovirus infected Sf9 cells using BodipyFL labeled bradykinin as substra...				J Med Chem 55: 7636-49 (2012) Article DOI: 10.1021/jm300663n BindingDB Entry DOI: 10.7270/Q2SJ1MRZ
					More data for this Ligand-Target Pair