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BDBM50085454 CHEMBL90388::N-formyl hydroxylamine containing dipeptide analogue

SMILES: ON(C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCc2ccccc2N(CC(O)=O)C1=O)C=O

InChI Key: InChIKey=VJMGHCZAAFBQOG-MOPGFXCFSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50085454   
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
Neutral Endopeptidase (NEP)


(Rattus norvegicus (Rat))
BDBM50085454
PNG
(CHEMBL90388 | N-formyl hydroxylamine containing di...)
Show SMILES ON(C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCc2ccccc2N(CC(O)=O)C1=O)C=O
Show InChI InChI=1S/C23H25N3O6/c27-15-25(32)13-18(12-16-6-2-1-3-7-16)22(30)24-19-11-10-17-8-4-5-9-20(17)26(23(19)31)14-21(28)29/h1-9,15,18-19,32H,10-14H2,(H,24,30)(H,28,29)/t18-,19+/m1/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 1.30n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Neutral endopeptidase


Bioorg Med Chem Lett 10: 257-60 (2000)


BindingDB Entry DOI: 10.7270/Q2BK1BJ8
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Oryctolagus cuniculus)
BDBM50085454
PNG
(CHEMBL90388 | N-formyl hydroxylamine containing di...)
Show SMILES ON(C[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCc2ccccc2N(CC(O)=O)C1=O)C=O
Show InChI InChI=1S/C23H25N3O6/c27-15-25(32)13-18(12-16-6-2-1-3-7-16)22(30)24-19-11-10-17-8-4-5-9-20(17)26(23(19)31)14-21(28)29/h1-9,15,18-19,32H,10-14H2,(H,24,30)(H,28,29)/t18-,19+/m1/s1
MMDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 5.30n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Angiotensin I converting enzyme


Bioorg Med Chem Lett 10: 257-60 (2000)


BindingDB Entry DOI: 10.7270/Q2BK1BJ8
More data for this
Ligand-Target Pair