BIOPEP-UWM: Report

ID 60
Name Antiviral peptide
sequence
NQF

Function:
Predicted ligand of SARS-CoV-2 parent protease (EC 3.4.22.69) (MEROPS ID: C30.007) (PDB ID: 6LU7)
 
Number of residues
3
Activity code
avi
Activity :
antiviral
Chemical mass 407.4200 Monoisotopic mass 407.1799
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])(CC(=O)N)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)O

InChI=1S/C18H25N5O6/c19-11(9-15(21)25)16(26)22-12(6-7-14(20)24)17(27)23-13(18(28)29)8-10-4-2-1-3-5-10/h1-5,11-13H,6-9,19H2,(H2,20,24)(H2,21,25)(H,22,26)(H,23,27)(H,28,29)/t11-,12-,13-/m0/s1

InChIKey=QPTAGIPWARILES-AVGNSLFASA-N


Bioactivity predicted using molecular docking



Database reference:
ChEBI: ID 159701

PubChem: CID 145454087