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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 = 'BDBM50287133'   
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))
BDBM50287133
PNG
(2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...)
Show SMILES NC(=O)CCC(NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O
Show InChI InChI=1S/C31H36N3O8P/c32-27(35)17-16-26(30(37)38)33-29(36)25(18-22-10-4-1-5-11-22)21-43(40,41)28(19-23-12-6-2-7-13-23)34-31(39)42-20-24-14-8-3-9-15-24/h1-15,25-26,28H,16-21H2,(H2,32,35)(H,33,36)(H,34,39)(H,37,38)(H,40,41)/t25?,26?,28-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 6.00E+3n/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))
BDBM50287133
PNG
(2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phe...)
Show SMILES NC(=O)CCC(NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O
Show InChI InChI=1S/C31H36N3O8P/c32-27(35)17-16-26(30(37)38)33-29(36)25(18-22-10-4-1-5-11-22)21-43(40,41)28(19-23-12-6-2-7-13-23)34-31(39)42-20-24-14-8-3-9-15-24/h1-15,25-26,28H,16-21H2,(H2,32,35)(H,33,36)(H,34,39)(H,37,38)(H,40,41)/t25?,26?,28-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a>1.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of neutral endopeptidase 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