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BDBM50287135 (R)-2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-3-methyl-butyric acid::CHEMBL24923

SMILES: CC(C)[C@@H](NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O

InChI Key: InChIKey=TVBUDTWGDVKZLU-DXISBFFWSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50287135   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Neprilysin


(Homo sapiens (Human))
BDBM50287135
PNG
((R)-2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2...)
Show SMILES CC(C)[C@@H](NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O
Show InChI InChI=1S/C31H37N2O7P/c1-22(2)28(30(35)36)33-29(34)26(18-23-12-6-3-7-13-23)21-41(38,39)27(19-24-14-8-4-9-15-24)32-31(37)40-20-25-16-10-5-11-17-25/h3-17,22,26-28H,18-21H2,1-2H3,(H,32,37)(H,33,34)(H,35,36)(H,38,39)/t26?,27-,28-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a>6.00E+4n/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
Neprilysin


(Homo sapiens (Human))
BDBM50287135
PNG
((R)-2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2...)
Show SMILES CC(C)[C@@H](NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O
Show InChI InChI=1S/C31H37N2O7P/c1-22(2)28(30(35)36)33-29(34)26(18-23-12-6-3-7-13-23)21-41(38,39)27(19-24-14-8-4-9-15-24)32-31(37)40-20-25-16-10-5-11-17-25/h3-17,22,26-28H,18-21H2,1-2H3,(H,32,37)(H,33,34)(H,35,36)(H,38,39)/t26?,27-,28-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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
Endothelin-converting enzyme 1


(Homo sapiens (Human))
BDBM50287135
PNG
((R)-2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2...)
Show SMILES CC(C)[C@@H](NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O
Show InChI InChI=1S/C31H37N2O7P/c1-22(2)28(30(35)36)33-29(34)26(18-23-12-6-3-7-13-23)21-41(38,39)27(19-24-14-8-4-9-15-24)32-31(37)40-20-25-16-10-5-11-17-25/h3-17,22,26-28H,18-21H2,1-2H3,(H,32,37)(H,33,34)(H,35,36)(H,38,39)/t26?,27-,28-/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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 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 (ECE1)


(Homo sapiens (Human))
BDBM50287135
PNG
((R)-2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2...)
Show SMILES CC(C)[C@@H](NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(O)=O
Show InChI InChI=1S/C31H37N2O7P/c1-22(2)28(30(35)36)33-29(34)26(18-23-12-6-3-7-13-23)21-41(38,39)27(19-24-14-8-4-9-15-24)32-31(37)40-20-25-16-10-5-11-17-25/h3-17,22,26-28H,18-21H2,1-2H3,(H,32,37)(H,33,34)(H,35,36)(H,38,39)/t26?,27-,28-/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 6.00E+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