BIOPEP-UWM: Report

ID 702
Name ACE inhibitor
sequence
VL
Function:
Predicted inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001) (PDB ID: 1O86)
 
Number of residues
2
Activity code
ah
Activity :
ACE inhibitor
Chemical mass 230.3031 Monoisotopic mass 230.1625
EC50 :
0.00 µM


Bibliographic data:
Authors
Chen J., Xie R., Mei Y., Chen W., Hu J., Liu H., Du H., Hao G., Ji X., Li S., Zhang J.
Title
Prospecting of novel angiotensin I-converting enzyme inhibitory peptides from bone collagen of Pelodiscus sinensis by computer-aided screening, molecular docking, and network pharmacology. Foods, 15, 663, 2026
Year Source
2026 Journal


Additional information:
BIOPEP-UWM Virtual database


SMILES: N[C@@]([H])(C(C)C)C(=O)N[C@@]([H])(CC(C)C)C(=O)O

InChI=1S/C11H22N2O3/c1-6(2)5-8(11(15)16)13-10(14)9(12)7(3)4/h6-9H,5,12H2,1-4H3,(H,13,14)(H,15,16)/t8-,9-/m0/s1

InChIKey=XCTHZFGSVQBHBW-IUCAKERBSA-N


Bioactivity predicted by molecular docking


Glucose uptake stimulating activity according to the BIOPEP-UWM database of bioactive peptides (ID 8320)
Inhibitor of Dipeptidyl Peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003) to the BIOPEP-UWM database of bioactive peptides (ID 8922)
Inhibitor of citrulline uptake in yeasts according to the ChEMBL database
Inhibitor of Angiotensin-converting enzyme (EC 3.4.15.1) (MEROPS ID: M02-001) according to the AHTPDB database; the PlantPepDB database

Bitter peptide according to the BIOPEP-UWM database of sensory peptides and amino acids (ID 110); the ChEMBL database


Database reference:
BioPepDB: ID biopep01406

BIOPEP-UWM database of bioactive peptides: ID 8320; 8922

BIOPEP-UWM database of sensory peptides and amino acids: ID 110

BRENDA: ligand Val-Leu

CAS: Registry No 3989-97-7

ChEBI: ID 75013

ChEMBL: ID CHEMBL55044

ChemSpider: ID 5361221

ECHA: Substance N-L-valyl-L-leucine

EPA CompTox: ID DTXSID00874268

EROP-Moscow: ID E23684

FeptideDB: ID 8320; 8922

FooDB: ID FDB112133

HMDB: ID HMDB0029131

J-GLOBAL: ID 200907052771268315

MBPDB: peptide VL

MeSH: Term Val-Leu

Metabolights: ID MTBLC75013

Nikkaji: ID J149.654I

PlantPepDB: ID PPepDB_210

PubChem: CID 6993117

SureChEMBL: ID SCHEMBL79236

UniChem: ID 362656

Wikidata: ID Q27145072

ZINC: ID ZINC000001605723