BIOPEP-UWM: Report
| ID | 56 |
| Name | Antiviral peptide |
| sequence |
| 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 | 414.4968 | Monoisotopic mass | 414.2260 | |
| EC50 : | 0.00 µM |
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| 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: N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)O InChI=1S/C22H30N4O4/c1-13(2)10-18(25-20(27)17-8-5-9-23-17)21(28)26-19(22(29)30)11-14-12-24-16-7-4-3-6-15(14)16/h3-4,6-7,12-13,17-19,23-24H,5,8-11H2,1-2H3,(H,25,27)(H,26,28)(H,29,30)/t17-,18-,19-/m0/s1 InChIKey=SRBFGSGDNNQABI-FHWLQOOXSA-N Bioactivity predicted using molecular docking Inhibitor of Angiotensin-converting enzyme (EC 3.4.15.1) (MEROPS ID: M02-001) according to the AHTPDB database; the BindingDB database; the BIOPEP-UWM database of bioactive peptides (ID 3531); the ChEMBL database; the EROP-Moscow database |
| Database reference: |
| AHTPDB: ID 1177, 1603, 2245, 4388, 5102, 6449 BindingDB: ID BDBM50348864 BioPepDB: ID biopep01069 BIOPEP-UWM database of bioactive peptides: ID 3531 ChEBI: ID 162451 ChEMBL: ID CHEMBL1807681 ChemSpider: ID 26618431 EROP-Moscow: ID E14733 FeptideDB: ID 3531 J-GLOBAL: ID 200907069117859932 MetaNetX: compound Pro-Leu-Trp; ID MNXM1125041 Nikkaji: ID J2.244.245G PubChem: CID 4320140 SATPdb: ID satpdb17916 SureChEMBL: ID SCHEMBL9653545 ZINC: ID ZINC000039812739 |