Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Endothelin-converting enzyme 1' and Ligand = 'BDBM50287136'   

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))	BDBM50287136 (2-{(R)-2-Benzyl-3-[(1-benzyloxycarbonylamino-2-phe...) Show SMILES NC(=N)NCCCC(NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O Show InChI InChI=1S/C32H40N5O7P/c33-31(34)35-18-10-17-27(30(39)40)36-29(38)26(19-23-11-4-1-5-12-23)22-45(42,43)28(20-24-13-6-2-7-14-24)37-32(41)44-21-25-15-8-3-9-16-25/h1-9,11-16,26-28H,10,17-22H2,(H,36,38)(H,37,41)(H,39,40)(H,42,43)(H4,33,34,35)/t26?,27?,28-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.30E+3	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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