BIOPEP-UWM: Report

ID 631
Name ACE inhibitor
sequence
QA

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 217.2218 Monoisotopic mass 217.1059
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])(CCC(=O)N)C(=O)N[C@@]([H])(C)C(=O)O

InChI=1S/C8H15N3O4/c1-4(8(14)15)11-7(13)5(9)2-3-6(10)12/h4-5H,2-3,9H2,1H3,(H2,10,12)(H,11,13)(H,14,15)/t4-,5-/m0/s1

InChIKey=FAQVCWVVIYYWRR-WHFBIAKZSA-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 8867)



Database reference:
BIOPEP-UWM database of bioacttive peptides: ID 8867

BRENDA: Ligand Gln-Ala

CAS: REgistry No 16874-70-7

ChEBI: ID 157823

ChEMBL: ID CHEMBL1221528

ChemSpider: ID 7988961

EPA DSSTox: ID DTXSID201314377

FooDB: ID FDB111839

HMDB: ID HMDB0028790

J-GLOBAL: ID 200907044095627037

Metabolomics Workbench: ID 78756

Nikkaji: ID J488.861H

PubChem: CID 9813211

SureChEMBL: ID SCHEMBL751144

UniChem: ID 646484

Wikidata: ID Q76411576

ZINC: ID ZINC000002556600