Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neprilysin' and Ligand = 'BDBM50411604'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neprilysin (Homo sapiens (Human))	BDBM50411604 (CHEMBL252009) Show SMILES CC[C@@H](C)[C@H](S)C(=O)N[C@@H](Cc1ccc(OCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C24H25F6NO4S/c1-3-13(2)20(36)21(32)31-19(22(33)34)10-14-4-6-18(7-5-14)35-12-15-8-16(23(25,26)27)11-17(9-15)24(28,29)30/h4-9,11,13,19-20,36H,3,10,12H2,1-2H3,(H,31,32)(H,33,34)/t13-,19+,20+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of human recombinant NEP by fluorescence assay				Bioorg Med Chem Lett 18: 1681-7 (2008) Article DOI: 10.1016/j.bmcl.2008.01.046 BindingDB Entry DOI: 10.7270/Q29K49Z2
					More data for this Ligand-Target Pair