BIOPEP-UWM: Report

ID 11204
Name PPARγ antagonist
sequence
W<Aad>

Function:
Antagonist of Peroxisome proliferator-activated receptor γ (PPARγ)
 
Number of residues
2
Activity code
ppar
Activity :
PPARγ antagonist
Chemical mass 347.3649 Monoisotopic mass 347.1476
EC50 :
0.00 µM



Bibliographic data:
Authors
Deng G., Liu Z., Ye F., Luo X., Zhu W., Shen X., Liu H., Jiang H.
Title
Tryptophan-containing dipeptide derivatives as potent PPARγ antagonists: Design, synthesis, biological evaluation, and molecular modeling. Eur. J. Med. Chem., 43, 2699-2716, 2008
Year Source
2008 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](CCCC(=O)O)C(=O)O

InChI=1S/C17H21N3O5/c18-12(8-10-9-19-13-5-2-1-4-11(10)13)16(23)20-14(17(24)25)6-3-7-15(21)22/h1-2,4-5,9,12,14,19H,3,6-8,18H2,(H,20,23)(H,21,22)(H,24,25)/t12-,14-/m0/s1

InChIKey=LKKDYAZRMNSFJN-JSGCOSHPSA-N


<Aad> - L-2-Aminoadipic acid (ID 246 in the BIOPEP-UWM repository of amino acids and modifications)



Database reference:
BindingDB: ID 50266633

ChEMBL: ID CHEMBL515773

ChemSpider: ID 24716573

DSigDB: ID d4ttd_6335

PubChem: CID 25185696

ZINC: ID ZINC000040406729