BIOPEP-UWM: Report

ID 8682
Name dipeptidyl peptidase IV inhibitor (DPP IV inhibitor)
sequence
WM
Function:
Inhibitor of Dipeptidyl Peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003)
 
Number of residues
2
Activity code
dpp
Activity :
dipeptidyl peptidase IV inhibitor
Chemical mass 335.4215 Monoisotopic mass 335.1299
IC50 :
243.10 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-derived peptides 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[N]([H])C2=CC=CC=C12)C(=O)N[C@@H](CCSC)C(=O)O

InChI=1S/C16H21N3O3S/c1-23-7-6-14(16(21)22)19-15(20)12(17)8-10-9-18-13-5-3-2-4-11(10)13/h2-5,9,12,14,18H,6-8,17H2,1H3,(H,19,20)(H,21,22)/t12-,14-/m0/s1

InChIKey: BVZABQIRMYTKCF-JSGCOSHPSA-N


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 9090); the BRENDA database; the EROP-Moscow database
Inhibitor of Dipeptidyl peptidase-III (DPP-III) (EC 3.4.14.4) (MEROPS ID: M49.001) according to the BIOPEP-UWM database of bioactive peptides (ID 9506)


Database reference:
AHTPDB: ID 1083, 1466, 2786, 4235, 4727, 5182, 6158

BioPepDB: ID biopep01523

BIOPEP-UWM database of bioactive peptides: ID 9090; 9506

BRENDA: Ligand Trp-Met

ChEMBL: ID CHEMBL1221997

ChemSpider: ID 5383129

EPA CompTox: ID DTXSID30427226

EPA DSSTox: ID DTXCID10378060

EROP-Moscow: ID E09198

J-GLOBAL: ID 200907052427309797

Nikkaji: ID J1.941.530I

PubChem: CID 7020173

SATPdb: ID satpdb23078

SureChEMBL: ID SCHEMBL2545492

ZINC: ID ZINC02561121