BIOPEP-UWM: Report

ID 280
Name XIAP inhibitor
sequence
LPF

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 375.4608 Monoisotopic mass 375.2151
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 database of bioactive peptides


SMILES: NCC(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(C(C)C)C(=O)NCC(=O)N1[C@@]([H])(CCC1)C(=O)N1[C@@]([H])(CCC1)C(=O)NCC(=O)O

InChI=1S/C26H41N7O8/c1-15(2)22(30-24(39)17-7-3-9-31(17)19(34)12-27)25(40)28-13-20(35)32-10-5-8-18(32)26(41)33-11-4-6-16(33)23(38)29-14-21(36)37/h15-18,22H,3-14,27H2,1-2H3,(H,28,40)(H,29,38)(H,30,39)(H,36,37)/t16-,17-,18-,22-/m0/s1

InChIKey= BXDJCQURUMWFJP-ORGXJRBJSA-N


Bioactivity predicted using molecular docking


Inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001) according to the AHTPDB database; the BIOPEP-UWM database of bioactive peptides (ID 9040); the EROP-Moscow database
Anti-inflammatory peptide according to the BIOPEP-UWM database of bioactive peptides (ID 9870)
Inhibitor of Dipeptidyl Peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003) according to the BIOPEP-UWM database of bioactive peptides (ID 10384)



Database reference:
AHTPDB: ID 1565, 2626, 5104

BioPepDB: ID biopep00846

BIOPEP-UWM database of bioactive peptides: ID 9040, 9870; 10384

EROP-Moscow: ID E09316

J-GLOBAL: ID 200907003013678170

Nikkaji: ID J2.687.063A

PubChem: CID 25183214

SATPdb: ID satpdb11746