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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Endothelin-converting enzyme 1' and Ligand = 'BDBM50046135'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Endothelin-converting enzyme 1


(Homo sapiens (Human))		BDBM50046135
PNG
(2-[2-(Ethoxy-hydroxy-phosphorylamino)-4-methyl-pen...)
Show SMILES CCOP([O-])(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C19H28N3O6P/c1-4-28-29(26,27)22-16(9-12(2)3)18(23)21-17(19(24)25)10-13-11-20-15-8-6-5-7-14(13)15/h5-8,11-12,16-17,20H,4,9-10H2,1-3H3,(H,21,23)(H,24,25)(H2,22,26,27)/p-1/t16-,17-/m0/s1
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PubMed
n/an/a 1.09E+5n/an/an/an/an/an/a



Monsanto Corp

Curated by ChEMBL


Assay Description
Inhibition of endothelin converting enzyme in an RIA assay using ET-1 as substrate

J Med Chem 36: 173-6 (1993)


BindingDB Entry DOI: 10.7270/Q22V2GR8
More data for this
Ligand-Target Pair