null

SMILES: CCCCCCC(=O)N(CCc1cccc(OC)c1)CC(O)[C@@H](NC(=O)Cn1c(O)csc1=S)c1ccccc1

InChI Key: InChIKey=PQZHNEJLBBLRLF-QFCCLOIZSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 36566   

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 D (Homo sapiens (Human))	BDBM36566 (FDB) Show SMILES CCCCCCC(=O)N(CCc1cccc(OC)c1)CC(O)[C@@H](NC(=O)Cn1c(O)csc1=S)c1ccccc1 |r| Show InChI InChI=1S/C30H39N3O5S2/c1-3-4-5-9-15-27(36)32(17-16-22-11-10-14-24(18-22)38-2)19-25(34)29(23-12-7-6-8-13-23)31-26(35)20-33-28(37)21-40-30(33)39/h6-8,10-14,18,21,25,29,34,37H,3-5,9,15-17,19-20H2,1-2H3,(H,31,35)/t25?,29-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	595	n/a	n/a	n/a	n/a	n/a	n/a	3.7	n/a
University of California Berkeley					Assay Description A fluorometric high through-put assay for inhibitor towards human liver cathepsin D from Calbiochem.				Chem Biol 4: 297-307 (1997) Article DOI: 10.1016/s1074-5521(97)90073-9 BindingDB Entry DOI: 10.7270/Q21R6NW9
					More data for this Ligand-Target Pair