BindingDB logo
myBDB logout

BDBM50021146 2-(1-Carboxymethyl-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-ylamino)-4-methyl-pentanoic acid methyl ester::CHEMBL290328

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

InChI Key: InChIKey=DIAKVMVEHAUODE-GJZGRUSLSA-N

Data: 1 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 1 hit for monomerid = 50021146   
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


(Homo sapiens (Human))
BDBM50021146
PNG
(2-(1-Carboxymethyl-2-oxo-2,3,4,5-tetrahydro-1H-ben...)
Show SMILES COC(=O)[C@H](CC(C)C)N[C@H]1CCc2ccccc2N(CC(O)=O)C1=O
Show InChI InChI=1S/C19H26N2O5/c1-12(2)10-15(19(25)26-3)20-14-9-8-13-6-4-5-7-16(13)21(18(14)24)11-17(22)23/h4-7,12,14-15,20H,8-11H2,1-3H3,(H,22,23)/t14-,15-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Angiotensin I converting enzyme


J Med Chem 28: 1603-6 (1985)


BindingDB Entry DOI: 10.7270/Q2ZK5H7D
More data for this
Ligand-Target Pair