BIOPEP-UWM: Report

ID 604
Name ACE inhibitor
sequence
DE
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 262.2161 Monoisotopic mass 262.0797
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](C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(=O)O

InChI=1S/C9H14N2O7/c10-4(3-7(14)15)8(16)11-5(9(17)18)1-2-6(12)13/h4-5H,1-3,10H2,(H,11,16)(H,12,13)(H,14,15)(H,17,18)/t4-,5-/m0/s1

InChIKey=CKAJHWFHHFSCDT-WHFBIAKZSA-N


Activity predicted using QSAR


Neuropeptide according to the EROP-Moscow database


Sour peptide according to the BIOPEP database of sensory peptide and amino acids (ID 242)
Umami peptide according to the BIOPEP database of sensory peptide and amino acids (ID 246)
Salty peptide according to the BIOPEP database of sensory peptide and amino acids (ID 247)
Inhibitor of Glutamate carboxypeptidase II (EC 3.4.17.21) (MEROPS ID: M28.010) according to the BIOPEP-UWM database of bioactive peptides (ID 10638); the BRENDA database; the ChEMBL database


Database reference:
ACToR: ID 6157-06-8

BindingDB: ID 50102262

BIOPEP-UWM database of bioactive peptides: ID 10638

BIOPEP-UWM database of sensory peptides and amino acids: ID 242; 246; 247

BRENDA: Ligand Asp-Glu

CAS: Registry No 6157-06-8

ChEBI: ID 73828

ChEMBL: ID CHEMBL420850

ChemIDplus: ID 006157068

ChemSpider: ID 133435

EPA DSSTox: ID DTXSID50977157

EROP-Moscow: ID E00596

HMDB: ID HMDB0028752

J-GLOBAL: ID 200907031024208152

Metabolights: ID MTBLC73828

Metabolomics Workbench: ID 78722

NIAID: ID 071536

Nikkaji: ID J81.155F

Plant Metabolite Hub: ID MS000008058

PubChem: ID 151403

SATPdb: ID satpdb16340

SureChEMBL: ID SCHEMBL1276945

UniChem: ID 502588

Wikidata: ID Q27144146

ZINC: ID ZINC000002522589