BIOPEP-UWM: Report

ID 8681
Name dipeptidyl peptidase IV inhibitor (DPP IV inhibitor)
sequence
WWW
Function:
Inhibitor of Dipeptidyl Peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003)
 
Number of residues
3
Activity code
dpp
Activity :
dipeptidyl peptidase IV inhibitor
Chemical mass 576.6437 Monoisotopic mass 576.2478
IC50 :
216.00 µM


Bibliographic data:
Authors
Nongonierma A. B., Mooney C., Shields D. C., FitzGerald R. J.
Title
In silico approaches to predict the potential of milk protein-derivedpeptides as dipeptidyl peptidase IV (DPP-IV) inhibitors. Peptides 57, 43-51, 2014
Year Source
2014 Journal


Additional information:
BIOPEP-UWM database of bioactive peptides


SMILES: N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)O

InChI=1S/C33H32N6O4/c34-25(13-19-16-35-26-10-4-1-7-22(19)26)31(40)38-29(14-20-17-36-27-11-5-2-8-23(20)27)32(41)39-30(33(42)43)15-21-18-37-28-12-6-3-9-24(21)28/h1-12,16-18,25,29-30,35-37H,13-15,34H2,(H,38,40)(H,39,41)(H,42,43)/t25-,29-,30-/m0/s1

InChIKey=KRCAKIVDAFTTGJ-ARVREXMNSA-N


Inhibitor of Angiotensin-converting enzyme (EC 3.4.15.1) (MEROPS ID: M02-001) according to the BIOPEP-UWM database of bioactive peptides; the EROP-Moscow database


Bitter peptide according to the BIOPEP-UWM database of sensory peptides and amino acids (ID 343)


Database reference:
BindingDB: ID 50169218

BIOPEP-UWM database of sensory peptides and amino acids: ID 343

CAS: Registry No 59005-82-2

ChEMBL: ID CHEMBL434535

ChemSpider: ID 23257174

EPA CompTox: ID DTXSID80658740

EROP-Moscow: ID E24731

J-GLOBAL: ID 200907051053602855

Metabolomics Workbench: ID 86213

Nikkaji: ID J2.284.672H

PubChem: CID 44398561

SureChEMBL: ID SCHEMBL9868128