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BDBM50085460 (4S,7S,12bR)-7-[(R)-2-Benzyl-3-(formyl-hydroxy-amino)-propionylamino]-6-oxo-1,2,3,4,6,7,8,12b-octahydro-benzo[c]pyrido[1,2-a]azepine-4-carboxylic acid::CHEMBL177551

SMILES: ON(C[C@@H](Cc1ccccc1)C(=O)N[C@H]1Cc2ccccc2[C@H]2CCC[C@H](N2C1=O)C(O)=O)C=O

InChI Key: InChIKey=BMRLLUBOZMRUIK-PNJWGLBASA-N

Data: 2 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50085460   
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))
BDBM50085460
PNG
((4S,7S,12bR)-7-[(R)-2-Benzyl-3-(formyl-hydroxy-ami...)
Show SMILES ON(C[C@@H](Cc1ccccc1)C(=O)N[C@H]1Cc2ccccc2[C@H]2CCC[C@H](N2C1=O)C(O)=O)C=O
Show InChI InChI=1S/C26H29N3O6/c30-16-28(35)15-19(13-17-7-2-1-3-8-17)24(31)27-21-14-18-9-4-5-10-20(18)22-11-6-12-23(26(33)34)29(22)25(21)32/h1-5,7-10,16,19,21-23,35H,6,11-15H2,(H,27,31)(H,33,34)/t19-,21+,22-,23+/m1/s1
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MMDB

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PC cid
PC sid
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PubMed
n/an/a 1.80n/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)
BDBM50085460
PNG
((4S,7S,12bR)-7-[(R)-2-Benzyl-3-(formyl-hydroxy-ami...)
Show SMILES ON(C[C@@H](Cc1ccccc1)C(=O)N[C@H]1Cc2ccccc2[C@H]2CCC[C@H](N2C1=O)C(O)=O)C=O
Show InChI InChI=1S/C26H29N3O6/c30-16-28(35)15-19(13-17-7-2-1-3-8-17)24(31)27-21-14-18-9-4-5-10-20(18)22-11-6-12-23(26(33)34)29(22)25(21)32/h1-5,7-10,16,19,21-23,35H,6,11-15H2,(H,27,31)(H,33,34)/t19-,21+,22-,23+/m1/s1
MMDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 3.40n/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