BIOPEP-UWM: Report
| ID | 276 |
| Name | XIAP inhibitor |
| sequence |
| Function: | |||
| Predicted ligand of ubiquitin ligase (XIAP) (EC 2.3.2.27) (Alpha Fold ID AF-P98170-F1-model-v2) | |||
| Number of residues | 3 |
Activity code | xiap |
| Activity : | XIAP inhibitor |
|||
| Chemical mass | 341.4445 | Monoisotopic mass | 341.2307 | |
| EC50 : | 0.00 µM |
|||
| Bibliographic data: | |
| Authors | |
| Fatoki T. H., Aluko R. E., Udenigwe C. C. | |
| Title | |
| In silico investigation of molecular targets, pharmacokinetics, and biological activities of chicken egg ovalbumin protein hydrolysates. J. Food Bioact., 17, 34–48, 2022 | |
| Year | Source |
| 2022 | Journal |
| Additional information: |
| BIOPEP-UWM Virtual database SMILES: N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CC(C)C)C(=O)O InChI=1S/C17H31N3O4/c1-5-11(4)14(20-15(21)12-7-6-8-18-12)16(22)19-13(17(23)24)9-10(2)3/h10-14,18H,5-9H2,1-4H3,(H,19,22)(H,20,21)(H,23,24)/t11-,12-,13-,14-/m0/s1 InChIKey=VZKBJNBZMZHKRC-XUXIUFHCSA-N Bioactivity predicted using molecular docking Predicted ligand of angiotensin-converting enzyme (EC 3.4.15.1) (MEROPS ID: M02-001) (PDB ID: 4C2N) according to the BIOPEP-UWM Virtual database (ID 260) Predicted inhibitor of Dipeptidyl peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003) (PDB ID: 3Q8W) according to the BIOPEP-UWM Virtual database (ID 286) |
| Database reference: |
| BIOPEP-UWM Virtual database: ID 260; 286 ChEBI: ID 162397 Metabolomics Workbench: ID 84846 PubChem: CID 145457495 |