BIOPEP-UWM: Report

ID 10216
Name Acetylcholinesterase inhibitor
sequence
KFVKKVVK

Function:
Inhibitor of Acetylcholinesterase (EC 3.1.1.7)
 
Number of residues
8
Activity code
ache
Activity :
AChE inhibitor
Chemical mass 975.2680 Monoisotopic mass 974.6621
IC50 :
0.80 µM



Bibliographic data:
Authors
Perumal P., Vasudevan M., Sridevi C., Manikandan S.
Title
Anticholinesterase activity of octa peptides related to human histatin 8: in-silico drug design and in-vitro. Asian J. Pharm. Clin. Res., 10, 115–117, 2017
Year Source
2017 Journal



Additional information:
BIOPEP-UWM database of bioactive peptides


SMILES: N[C@@]([H])(CCCCN)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)N[C@@H](CC1=CN=C[NH]1)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@H](CC1=CN=C[NH]1)C(=O)N[C@@H](CC1=CN=C[NH]1)C(=O)N[C@@]([H])(CO)C(=O)O

InChI=1S/C47H68N16O12/c48-14-6-4-10-31(50)40(67)59-34(16-27-8-2-1-3-9-27)43(70)61-35(17-28-20-51-24-54-28)44(71)58-33(12-13-39(65)66)42(69)57-32(11-5-7-15-49)41(68)60-36(18-29-21-52-25-55-29)45(72)62-37(19-30-22-53-26-56-30)46(73)63-38(23-64)47(74)75/h1-3,8-9,20-22,24-26,31-38,64H,4-7,10-19,23,48-50H2,(H,51,54)(H,52,55)(H,53,56)(H,57,69)(H,58,71)(H,59,67)(H,60,68)(H,61,70)(H,62,72)(H,63,73)(H,65,66)(H,74,75)/t31-,32-,33-,34-,35-,36-,37-,38-/m0/s1

InChIKey=PROKGHCVUCIUFW-QSVFAHTRSA-N



Database reference: