Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Endothelin-converting enzyme 1' and Ligand = 'BDBM50287138'   

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
Endothelin-converting enzyme 1 (Homo sapiens (Human))	BDBM50287138 (2-[(2-{[hydroxy(4-phenyl-butyl)phosphoryl]amino}-3...) Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NP(O)(=O)CCCCc1ccccc1 Show InChI InChI=1S/C30H34N3O5P/c34-29(32-28(30(35)36)20-24-21-31-26-17-8-7-16-25(24)26)27(19-23-14-5-2-6-15-23)33-39(37,38)18-10-9-13-22-11-3-1-4-12-22/h1-8,11-12,14-17,21,27-28,31H,9-10,13,18-20H2,(H,32,34)(H,35,36)(H2,33,37,38)/t27-,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of endothelin-converting enzyme in human umbilical vein endothelial cells				Bioorg Med Chem Lett 6: 1323-1326 (1996) Article DOI: 10.1016/0960-894X(96)00227-2 BindingDB Entry DOI: 10.7270/Q2Q81DKV
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