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BDBM50018211 3-(2-Benzyl-3-hydroxycarbamoyl-propionylamino)-butyric acid::CHEMBL36094

SMILES: CC(CC(O)=O)NC(=O)C(CC(=O)NO)Cc1ccccc1

InChI Key: InChIKey=UKHIXBAHBRUVMS-UHFFFAOYSA-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 = 50018211   
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
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50018211
PNG
(3-(2-Benzyl-3-hydroxycarbamoyl-propionylamino)-but...)
Show SMILES CC(CC(O)=O)NC(=O)C(CC(=O)NO)Cc1ccccc1
Show InChI InChI=1S/C15H20N2O5/c1-10(7-14(19)20)16-15(21)12(9-13(18)17-22)8-11-5-3-2-4-6-11/h2-6,10,12,22H,7-9H2,1H3,(H,16,21)(H,17,18)(H,19,20)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 350n/an/an/an/an/an/a



INSERM

Curated by ChEMBL


Assay Description
Inhibition of Aminopeptidase N activity in pig kidney with 10 nM [3H]-Leu-enkephalin as substrate


J Med Chem 32: 1497-503 (1989)


BindingDB Entry DOI: 10.7270/Q2610Z9F
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50018211
PNG
(3-(2-Benzyl-3-hydroxycarbamoyl-propionylamino)-but...)
Show SMILES CC(CC(O)=O)NC(=O)C(CC(=O)NO)Cc1ccccc1
Show InChI InChI=1S/C15H20N2O5/c1-10(7-14(19)20)16-15(21)12(9-13(18)17-22)8-11-5-3-2-4-6-11/h2-6,10,12,22H,7-9H2,1H3,(H,16,21)(H,17,18)(H,19,20)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 445n/an/an/an/an/an/a



INSERM

Curated by ChEMBL


Assay Description
Inhibition of Aminopeptidase N activity in pig kidney with 10 nM [3H]Leu-enkephalin as substrate


J Med Chem 32: 1497-503 (1989)


BindingDB Entry DOI: 10.7270/Q2610Z9F
More data for this
Ligand-Target Pair
Neprilysin


(Oryctolagus cuniculus (rabbit))
BDBM50018211
PNG
(3-(2-Benzyl-3-hydroxycarbamoyl-propionylamino)-but...)
Show SMILES CC(CC(O)=O)NC(=O)C(CC(=O)NO)Cc1ccccc1
Show InChI InChI=1S/C15H20N2O5/c1-10(7-14(19)20)16-15(21)12(9-13(18)17-22)8-11-5-3-2-4-6-11/h2-6,10,12,22H,7-9H2,1H3,(H,16,21)(H,17,18)(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2n/an/an/an/an/an/a



INSERM

Curated by ChEMBL


Assay Description
Inhibition of neutral endopeptidase activity in rabbit kidney with 20 nM [3H]D-Ala2-Leu-enkephalin as substrate


J Med Chem 32: 1497-503 (1989)


BindingDB Entry DOI: 10.7270/Q2610Z9F
More data for this
Ligand-Target Pair
Neprilysin


(Oryctolagus cuniculus (rabbit))
BDBM50018211
PNG
(3-(2-Benzyl-3-hydroxycarbamoyl-propionylamino)-but...)
Show SMILES CC(CC(O)=O)NC(=O)C(CC(=O)NO)Cc1ccccc1
Show InChI InChI=1S/C15H20N2O5/c1-10(7-14(19)20)16-15(21)12(9-13(18)17-22)8-11-5-3-2-4-6-11/h2-6,10,12,22H,7-9H2,1H3,(H,16,21)(H,17,18)(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.70n/an/an/an/an/an/a



INSERM

Curated by ChEMBL


Assay Description
Inhibition of neutral endopeptidase activity in rabbit kidney with 20 nM [3H]-D-Ala2-Leu-enkephalin as substrate


J Med Chem 32: 1497-503 (1989)


BindingDB Entry DOI: 10.7270/Q2610Z9F
More data for this
Ligand-Target Pair