BIOPEP-UWM: Report

ID 10239
Name beta-casomorphin-5 butyrylcholinesterase inhibitor
sequence
YPFPG
Function:
Inhibitor of Butyrylcholinesterase (EC 3.1.1.8)
 
Number of residues
5
Activity code
bche
Activity :
BChE inhibitor
Chemical mass 579.6426 Monoisotopic mass 579.2684
IC50 :
238.50 µM


Bibliographic data:
Authors
Ji D., Ma J., Dai J., Xu M., Harris, P. W. R., Brimble M. A., Agyei D.
Title
Anticholinesterase inhibition, drug-likeness assessment, and molecular docking evaluation of milk protein-derived opioid peptides for the control of Alzheimer’s disease. Dairy, 3, 422–437, 2022
Year Source
2022 Journal


Additional information:
BIOPEP-UWM database of bioactive peptides

SMILES: N[C@@H](CC1=CC=C(C=C1)O)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)N1[C@@]([H])(CCC1)C(=O)NCC(=O)O

InChI=1S/C30H37N5O7/c31-22(16-20-10-12-21(36)13-11-20)29(41)34-14-5-9-25(34)28(40)33-23(17-19-6-2-1-3-7-19)30(42)35-15-4-8-24(35)27(39)32-18-26(37)38/h1-3,6-7,10-13,22-25,36H,4-5,8-9,14-18,31H2,(H,32,39)(H,33,40)(H,37,38)/t22-,23-,24-,25-/m0/s1

InChIKey=PKKIDZFGRQACGB-QORCZRPOSA-N


Opioid agonist according to the BindingDB database; the BIOPEP-UWM database of bioactive peptides (ID 3263); the ChEMBL database; the EROP-Moscow database; the MBPDB database; the PepBank database; the PubChem database
Immunomodulating peptide according to the BIOPEP-UWM database of bioactive peptides (ID 10153); the MBPDB database
Anticancer peptide according to the BIOPEP-UWM database of bioactive peptides (ID 10154); the MBPDB database
Inhibitor of Acetylcholinesterase (EC 3.1.1.7) according to the BIOPEP-UWM database of bioactive peptides (ID 10238)


Database reference:
BindingDB: ID 50089071

BIOPEP-UWM database of bioactive peptides: ID 3263; 10153; 10154; 10238

Brainpeps: ID 33

BRENDA: Ligand Tyr-Pro-Phe-Pro-Gly

CAS: Registry No 72122-63-5

ChEMBL: ID CHEMBL2370515

ChemSpider: ID 8546433

DFBP: ID DFBPOPIO0012

EROP-Moscow: ID E00234

FeptideDB: ID 3263

J-GLOBAL: ID 200907035993654602

MBPDB: peptide YPFPG

MeSH: term beta-casomorphin 5; ID 67034812

Nikkaji: ID J39.396G

PepBank: peptide YPFPG

PubChem: CID 10370988

SATPdb: ID satpdb11165

ZINC: ID ZINC000085591240