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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Endothelin-converting enzyme 1' and Ligand = 'BDBM50287139'   
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))
BDBM50287139
PNG
(2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...)
Show SMILES OC(=O)C(Cc1ccc(O)cc1)NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C35H37N2O8P/c38-30-18-16-27(17-19-30)21-31(34(40)41)36-33(39)29(20-25-10-4-1-5-11-25)24-46(43,44)32(22-26-12-6-2-7-13-26)37-35(42)45-23-28-14-8-3-9-15-28/h1-19,29,31-32,38H,20-24H2,(H,36,39)(H,37,42)(H,40,41)(H,43,44)/t29?,31?,32-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 1.20E+4n/an/an/an/an/an/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
More data for this
Ligand-Target Pair
Endothelin-converting enzyme 1


(Homo sapiens (Human))
BDBM50287139
PNG
(2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...)
Show SMILES OC(=O)C(Cc1ccc(O)cc1)NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C35H37N2O8P/c38-30-18-16-27(17-19-30)21-31(34(40)41)36-33(39)29(20-25-10-4-1-5-11-25)24-46(43,44)32(22-26-12-6-2-7-13-26)37-35(42)45-23-28-14-8-3-9-15-28/h1-19,29,31-32,38H,20-24H2,(H,36,39)(H,37,42)(H,40,41)(H,43,44)/t29?,31?,32-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 1.20E+4n/an/an/an/an/an/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
More data for this
Ligand-Target Pair