BIOPEP-UWM: Report

ID 640
Name ACE inhibitor
sequence
SL
Function:
Predicted inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001)
 
Number of residues
2
Activity code
ah
Activity :
ACE inhibitor
Chemical mass 218.2495 Monoisotopic mass 218.1262
EC50 :
0.00 µM


Bibliographic data:
Authors
Gu J., Yue S., Yang X., Lu Z., Wang Z., Wei X., Zhou L., Zhao Z., Shi Z., Zhao Z.
Title
Unlocking novel angiotensin-converting enzyme inhibitory peptides from Nili Ravi buffalo milk β-casein: A synergistic strategy combining targeted hydrolysis, 3D-QSAR modeling, and mechanistic insights. Food Biosci., 71, 107346, 2025
Year Source
2025 Journal


Additional information:
BIOPEP-UWM Virtual database



SMILES: N[C@@]([H])(CO)C(=O)N[C@@]([H])(CC(C)C)C(=O)O

InChI=1S/C9H18N2O4/c1-5(2)3-7(9(14)15)11-8(13)6(10)4-12/h5-7,12H,3-4,10H2,1-2H3,(H,11,13)(H,14,15)/t6-,7-/m0/s1

InChIKey=NFDYGNFETJVMSE-BQBZGAKWSA-N


Activity predicted using QSAR


Inhibitor of Dipeptidyl Peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003) according to the BIOPEP-UWM database of biocative peptides (ID 8560)
Regulator of phosphoglycerate kinase (EC 2.7.2.3) according to the BIOPEP-UWM database of biocative peptides (ID 9955)


Database reference:
AHTPDB: ID 3884

BioPepDB: ID biopep01248

BIOPEP-UWM database of bioactive peptides: ID 8560; 9955

BIOPEP-UWM database of sensory peptides and amino acids: ID 492

ChEBI: ID 74815

ChEMBL: ID CHEMBL52406

ChemSpider: ID 5378727

Crystallography Open Database: ID 2011762

EROP-Moscow: ID E04547

FeptideDB: ID 8560

FooDB: ID FDB112051

HMDB: ID HMDB0029043

J-GLOBAL: ID 200907076753227691

Metabolights: ID MTBLC74815

Metabolomics Workbench: ID 78966

Nikkaji: ID J149.634D

NMRShiftDB: ID 60021746

PubChem: CID 7015694

SATPdb: ID satpdb20026

SureChEMBL: ID SCHEMBL3777970

UniChem: ID 368305

Wikidata: ID Q27144925

ZINC: ID ZINC000002516129