BIOPEP-UWM: Report

ID 65
Name Antiviral peptide
sequence
QW
Function:
Predicted ligand of SARS-CoV-2 parent protease (EC 3.4.22.69) (MEROPS ID: C30.007) (PDB ID: 6LU7)
 
Number of residues
2
Activity code
avi
Activity :
antiviral
Chemical mass 332.3536 Monoisotopic mass 332.1480
EC50 :
0.00 µM


Bibliographic data:
Authors
Behzadipour Y., Gholampour M., Pirhadi S., Seradj H., Khoshneviszadeh M., Hemmati S.
Title
Viral 3CLpro as a target for antiviral intervention using milk‑derived bioactive peptides. Int. J. Pept. Res. Therapeut., 27, 2703–2716, 2021
Year Source
2021 Journal


Additional information:
BIOPEP-UWM Virtual database


SMILES: N[C@@]([H])(CCC(=O)N)C(=O)N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)O

InChI=1S/C16H20N4O4/c17-11(5-6-14(18)21)15(22)20-13(16(23)24)7-9-8-19-12-4-2-1-3-10(9)12/h1-4,8,11,13,19H,5-7,17H2,(H2,18,21)(H,20,22)(H,23,24)/t11-,13-/m0/s1

InChIKey=ZQFAGNFSIZZYBA-AAEUAGOBSA-N


Bioactivity predicted using molecular docking


Inhibitor of Dipeptidyl Peptidase IV (EC 3.4.14.5) (MEROPS ID: Skh09.003) according to the BIOPEP-UWM dabatase of bioactive peptides (ID 8880)
Antioxidative peptide according to the EROP-Moscow database
Inhibitor of Angiotensin-converting enzyme (EC 3.4.15.1) (MEROPS ID: M02-001) according to the EROP-Moscow database


Database reference:
BIOPEP-UWM database of bioactive peptides: ID 8880

ChEBI: ID 141431

ChemSpider: ID 57558077

EPA CompTox: ID DTXSID30648959

EROP-Moscow: ID E10615

FeptideDB: ID 8880

FooDB: ID FDB111854

HMDB: ID HMDB0028808

J-GLOBAL: ID 201407058609422945

Nikkaji: ID J3.262.882F

PubChem: CID 25176542

SureChEMBL: ID SCHEMBL1898083