BDBM183919 US9150526, 177

SMILES: CCOc1ccccc1-c1cc(Cl)cc(c1)C(CC(O)=O)c1nnc(C)o1

InChI Key: InChIKey=KIHMCJYYGSAHPC-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 = 183919   

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))	BDBM183919 (US9150526, 177) Show SMILES CCOc1ccccc1-c1cc(Cl)cc(c1)C(CC(O)=O)c1nnc(C)o1 Show InChI InChI=1S/C20H19ClN2O4/c1-3-26-18-7-5-4-6-16(18)13-8-14(10-15(21)9-13)17(11-19(24)25)20-23-22-12(2)27-20/h4-10,17H,3,11H2,1-2H3,(H,24,25)	PDB MMDB B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	24	n/a	n/a	n/a	n/a	6.0	37
Sanofi US Patent					Assay Description Recombinant human cathepsin A (residues 29-480, with a C-terminal 10-His tag; R&D Systems, #1049-SE) was proteolytically activated with recombinant h...				US Patent US9150526 (2015) BindingDB Entry DOI: 10.7270/Q2QR4VXP
					More data for this Ligand-Target Pair