BIOPEP-UWM: Report

ID 699
Name ACE inhibitor
sequence
CIH

Function:
Predicted inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001) (PDB ID: 1O86)
 
Number of residues
3
Activity code
ah
Activity :
ACE inhibitor
Chemical mass 371.4552 Monoisotopic mass 371.1622
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])([C@]([H])(CC)C)C(=O)N[C@@H](CC1=CN=C[NH]1)C(=O)O

InChI=1S/C15H25N5O4S/c1-3-8(2)12(20-13(21)10(16)6-25)14(22)19-11(15(23)24)4-9-5-17-7-18-9/h5,7-8,10-12,25H,3-4,6,16H2,1-2H3,(H,17,18)(H,19,22)(H,20,21)(H,23,24)/t8-,10-,11-,12-/m0/s1

InChIKey=PRHGYQOSEHLDRW-VGDYDELISA-N


Bioactivity predicted by molecular docking



Database reference:
ChEBI: ID 161437

Metabolomics Workbench: ID 80844

PubChem: CID 145454779

UniChem: ID 176703348

Wikidata: ID Q106015741