BIOPEP-UWM: Report

ID 632
Name ACE inhibitor
sequence
NV

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 231.2483 Monoisotopic mass 231.1215
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])(CC(=O)N)C(=O)N[C@@]([H])(C(C)C)C(=O)O

InChI=1S/C9H17N3O4/c1-4(2)7(9(15)16)12-8(14)5(10)3-6(11)13/h4-5,7H,3,10H2,1-2H3,(H2,11,13)(H,12,14)(H,15,16)/t5-,7-/m0/s1

InChIKey=KWBQPGIYEZKDEG-FSPLSTOPSA-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 bioactive peptides ID 8851)




Database reference:
BIOPEP-UWM database of bioactive peptides: ID 8851

BRENDA: Ligand L-asparaginyl-L-valine

ChEBI: ID 73825

ChemSpider: ID 5382949

MetaboLights: ID MTBLC73825

Metabolomics Workbench: ID 78715

PubChem: CID 7019993

SureChEMBL: ID SCHEMBL29426362

UniChem: ID 34729541

Wikidata: ID Q27144142

ZINC: ID ZINC000002560966