BIOPEP-UWM: Report

ID 628
Name ACE inhibitor
sequence
PTESQS

Function:
Predicted inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001)
 
Number of residues
6
Activity code
ah
Activity :
ACE inhibitor
Chemical mass 647.6305 Monoisotopic mass 647.2752
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: N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])(CO)C(=O)O

InChI=1S/C25H41N7O13/c1-11(35)19(32-20(39)12-3-2-8-27-12)24(43)29-14(5-7-18(37)38)21(40)30-15(9-33)23(42)28-13(4-6-17(26)36)22(41)31-16(10-34)25(44)45/h11-16,19,27,33-35H,2-10H2,1H3,(H2,26,36)(H,28,42)(H,29,43)(H,30,40)(H,31,41)(H,32,39)(H,37,38)(H,44,45)/t11-,12+,13+,14+,15+,16+,19+/m1/s1

InChIKey=CPVDWIGJUCAJTO-LDDUNXDZSA-N


Activity predicted using QSAR



Database reference: