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BDBM50027514 2-(2-Carboxymethyl-3-phenyl-propionylamino)-4-methyl-pentanoic acid

SMILES: CC(C)CC(NC(=O)C(CC([O-])=O)Cc1ccccc1)C([O-])=O

InChI Key: InChIKey=NCSSMGXILSGJBE-UHFFFAOYSA-L

Data: 2 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 2 hits for monomerid = 50027514   
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
Angiotensin-converting enzyme


(Mus musculus)
BDBM50027514
PNG
(2-(2-Carboxymethyl-3-phenyl-propionylamino)-4-meth...)
Show SMILES CC(C)CC(NC(=O)C(CC([O-])=O)Cc1ccccc1)C([O-])=O
Show InChI InChI=1S/C17H23NO5/c1-11(2)8-14(17(22)23)18-16(21)13(10-15(19)20)9-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3,(H,18,21)(H,19,20)(H,22,23)/p-2
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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
50% Inhibitory potency against angiotensin I converting enzyme from mouse striatum.


J Med Chem 26: 60-5 (1983)


BindingDB Entry DOI: 10.7270/Q2Q81DP6
More data for this
Ligand-Target Pair
Neprilysin


(Mus musculus)
BDBM50027514
PNG
(2-(2-Carboxymethyl-3-phenyl-propionylamino)-4-meth...)
Show SMILES CC(C)CC(NC(=O)C(CC([O-])=O)Cc1ccccc1)C([O-])=O
Show InChI InChI=1S/C17H23NO5/c1-11(2)8-14(17(22)23)18-16(21)13(10-15(19)20)9-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3,(H,18,21)(H,19,20)(H,22,23)/p-2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a 800n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
50% Inhibitory potency against enkephalinase from mouse striatum.


J Med Chem 26: 60-5 (1983)


BindingDB Entry DOI: 10.7270/Q2Q81DP6
More data for this
Ligand-Target Pair