BIOPEP-UWM: Report

ID 703
Name ACE inhibitor
sequence
CH

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 258.2980 Monoisotopic mass 258.0784
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])(CS)C(=O)N[C@@H](CC1=CN=C[NH]1)C(=O)O

InChI=1S/C9H14N4O3S/c10-6(3-17)8(14)13-7(9(15)16)1-5-2-11-4-12-5/h2,4,6-7,17H,1,3,10H2,(H,11,12)(H,13,14)(H,15,16)/t6-,7-/m0/s1

InChIKey=LVNMAAGSAUGNIC-BQBZGAKWSA-N


Bioactivity predicted by molecular docking



Database reference:
ChEBI: ID 157807

ChEMBL: ID CHEMBL122613

ChemSpider: ID 9783337

EPA CompTox: ID DTXSID501371609

J-GLOBAL: ID 200907074916727600

Metabolomics Workbench: ID 78744

Nikkaji: ID J1.738.588G

PubChem: CID 11608582

SureChEMBL: ID SCHEMBL1984006

UniChem: ID 206979

Wikidata: ID Q106026477