BIOPEP-UWM: Report

ID 599
Name ACE inhibitor
sequence
MPF

Function:
Predicted inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001)
 
Number of residues
3
Activity code
ah
Activity :
ACE inhibitor
Chemical mass 393.5004 Monoisotopic mass 393.1716
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])(CCSC)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)O

InChI=1S/C19H27N3O4S/c1-27-11-9-14(20)18(24)22-10-5-8-16(22)17(23)21-15(19(25)26)12-13-6-3-2-4-7-13/h2-4,6-7,14-16H,5,8-12,20H2,1H3,(H,21,23)(H,25,26)/t14-,15-,16-/m0/s1

InChIKey=MQASRXPTQJJNFM-JYJNAYRXSA-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 10385)



Database reference:
ChEBI: ID 160923

Metabolomics Workbench: ID 84095

PubChem: CID 145457008

UniChem: ID 176705529

Wikidata: ID Q106015138