BIOPEP-UWM: Report

ID 61
Name Antiviral peptide
sequence
FH

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 302.3277 Monoisotopic mass 302.1375
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](CC1=CC=C(C=C1))C(=O)N[C@@H](CC1=CN=C[NH]1)C(=O)O

InChI=1S/C15H18N4O3/c16-12(6-10-4-2-1-3-5-10)14(20)19-13(15(21)22)7-11-8-17-9-18-11/h1-5,8-9,12-13H,6-7,16H2,(H,17,18)(H,19,20)(H,21,22)/t12-,13-/m0/s1

InChIKey=OHUXOEXBXPZKPT-STQMWFEESA-N


Bioactivity predicted using molecular docking



Database reference:
ChEBI: ID 73634

ChemSpider: ID 8141751

EPA CompTox: ID DTXSID80433453

FooDB: ID FDB112016

HMDB: ID HMDB0028997

J-GLOBAL: ID 200907072862662602

MeSH: ID C022144; terms: His-Phe, histidylphenylalanine

Nikkaji: ID J88.865F

PubChem: CID 9966159

SureChEMBL: ID SCHEMBL7277021