Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50037537   

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))	BDBM50159363 (CHEMBL177000 | methyl 2-(2-{N-methyl-1-[(4R)-1-(na...) Show SMILES COC(=O)c1ccccc1NC(=O)CN(C)C(=O)C1C[C@@H](S)CN1S(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C26H27N3O6S2/c1-28(16-24(30)27-22-10-6-5-9-21(22)26(32)35-2)25(31)23-14-19(36)15-29(23)37(33,34)20-12-11-17-7-3-4-8-18(17)13-20/h3-13,19,23,36H,14-16H2,1-2H3,(H,27,30)/t19-,23?/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
University Institute of Pathology Curated by ChEMBL					Assay Description Inhibitory concentration against Neprilysin				J Med Chem 48: 483-98 (2005) Article DOI: 10.1021/jm040857x BindingDB Entry DOI: 10.7270/Q2VM4D1H
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50159367 ((2S,4R)-4-Benzoylsulfanyl-2-(2,4,5-trifluoro-benzy...) Show SMILES Fc1cc(F)c(COC[C@@H]2C[C@H](CN2C(=O)Oc2cccc3OCCOc23)SC(=O)c2ccccc2)cc1F Show InChI InChI=1S/C28H24F3NO6S/c29-21-13-23(31)22(30)11-18(21)15-35-16-19-12-20(39-27(33)17-5-2-1-3-6-17)14-32(19)28(34)38-25-8-4-7-24-26(25)37-10-9-36-24/h1-8,11,13,19-20H,9-10,12,14-16H2/t19-,20+/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University Institute of Pathology Curated by ChEMBL					Assay Description Inhibitory concentration against Neprilysin				J Med Chem 48: 483-98 (2005) Article DOI: 10.1021/jm040857x BindingDB Entry DOI: 10.7270/Q2VM4D1H
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50159365 ((3R,5S)-5-{[(2,5-difluorobenzyl)amino]methyl}-1-(5...) Show SMILES CCCc1cnc(nc1)N1C[C@H](S)CC1CNCc1cc(F)ccc1F Show InChI InChI=1S/C19H24F2N4S/c1-2-3-13-8-23-19(24-9-13)25-12-17(26)7-16(25)11-22-10-14-6-15(20)4-5-18(14)21/h4-6,8-9,16-17,22,26H,2-3,7,10-12H2,1H3/t16?,17-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University Institute of Pathology Curated by ChEMBL					Assay Description Inhibitory concentration against Neprilysin				J Med Chem 48: 483-98 (2005) Article DOI: 10.1021/jm040857x BindingDB Entry DOI: 10.7270/Q2VM4D1H
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50159364 (CHEMBL192441 | isopropyl (2S,4R)-2-{[(2,5-difluoro...) Show SMILES CC(C)OC(=O)N1C[C@H](S)CC1CNCc1cc(F)ccc1F Show InChI InChI=1S/C16H22F2N2O2S/c1-10(2)22-16(21)20-9-14(23)6-13(20)8-19-7-11-5-12(17)3-4-15(11)18/h3-5,10,13-14,19,23H,6-9H2,1-2H3/t13?,14-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University Institute of Pathology Curated by ChEMBL					Assay Description Inhibitory concentration against Neprilysin				J Med Chem 48: 483-98 (2005) Article DOI: 10.1021/jm040857x BindingDB Entry DOI: 10.7270/Q2VM4D1H
					More data for this Ligand-Target Pair