Detalles de la búsqueda
1.
Bony Fish Arachidonic Acid 15-Lipoxygenases Exhibit Different Catalytic Properties than Their Mammalian Orthologs, Suggesting Functional Enzyme Evolution during Vertebrate Development.
Int J Mol Sci
; 24(18)2023 Sep 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-37762455
2.
Oxygenation of endocannabinoids by mammalian lipoxygenase isoforms.
Biochim Biophys Acta Mol Cell Biol Lipids
; 1866(6): 158918, 2021 06.
Artículo
en Inglés
| MEDLINE | ID: mdl-33662546
3.
Design, synthesis, and biological evaluation of prenylated chalcones as 5-LOX inhibitors.
Bioorg Med Chem
; 18(16): 5807-15, 2010 Aug 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-20667741
4.
Application of per-residue energy decomposition to identify the set of amino acids critical for in silico prediction of COX-2 inhibitory activity.
Heliyon
; 6(10): e04944, 2020 Oct.
Artículo
en Inglés
| MEDLINE | ID: mdl-33083581
5.
Structure prediction of neuroendocrine convertase -2: a potential target in various cancers.
Protein Pept Lett
; 16(4): 383-91, 2009.
Artículo
en Inglés
| MEDLINE | ID: mdl-19356135
6.
MM-PBSA and per-residue decomposition energy studies on 7-Phenyl-imidazoquinolin-4(5H)-one derivatives: Identification of crucial site points at microsomal prostaglandin E synthase-1 (mPGES-1) active site.
Int J Biol Macromol
; 119: 352-359, 2018 Nov.
Artículo
en Inglés
| MEDLINE | ID: mdl-30031079
7.
Role of Topological, Electronic, Geometrical, Constitutional and Quantum Chemical Based Descriptors in QSAR: mPGES-1 as a Case Study.
Curr Top Med Chem
; 18(13): 1075-1090, 2018.
Artículo
en Inglés
| MEDLINE | ID: mdl-30027847
8.
Deciphering the mechanism behind the varied binding activities of COXIBs through Molecular Dynamic Simulations, MM-PBSA binding energy calculations and per-residue energy decomposition studies.
J Biomol Struct Dyn
; 35(4): 868-882, 2017 Mar.
Artículo
en Inglés
| MEDLINE | ID: mdl-26982261
9.
Insights into the structure activity relationship of mPGES-1 inhibitors: Hints for better inhibitor design.
Int J Biol Macromol
; 88: 624-32, 2016 Jul.
Artículo
en Inglés
| MEDLINE | ID: mdl-27012893
10.
Understanding the Dual Inhibition of COX-2 and Carbonic Anhydrase-II by Celecoxib and CG100649 Using Density Functional Theory Calculations and other Molecular Modelling Approaches.
Protein Pept Lett
; 22(10): 903-12, 2015.
Artículo
en Inglés
| MEDLINE | ID: mdl-26095375
11.
Exploration of binding site pattern in arachidonic acid metabolizing enzymes, Cyclooxygenases and Lipoxygenases.
BMC Res Notes
; 8: 152, 2015 Apr 16.
Artículo
en Inglés
| MEDLINE | ID: mdl-25886468
12.
Graphlet signature-based scoring method to estimate protein-ligand binding affinity.
R Soc Open Sci
; 1(4): 140306, 2014 Dec.
Artículo
en Inglés
| MEDLINE | ID: mdl-26064572
13.
Functional interpretation of a non-gut hemocoelic tissue aminopeptidase N (APN) in a lepidopteran insect pest Achaea janata.
PLoS One
; 8(11): e79468, 2013.
Artículo
en Inglés
| MEDLINE | ID: mdl-24244508
14.
Discovery and biological evaluation of novel 1,4-benzoquinone and related resorcinol derivatives that inhibit 5-lipoxygenase.
Eur J Med Chem
; 67: 269-79, 2013 Sep.
Artículo
en Inglés
| MEDLINE | ID: mdl-23871907
15.
Structure and ligand based drug design strategies in the development of novel 5- LOX inhibitors.
Curr Med Chem
; 19(22): 3763-78, 2012.
Artículo
en Inglés
| MEDLINE | ID: mdl-22680930
16.
Structure based drug design, synthesis and evaluation of 4-(benzyloxy)-1-phenylbut-2-yn-1-ol derivatives as 5-lipoxygenase inhibitors.
Eur J Med Chem
; 47(1): 351-9, 2012 Jan.
Artículo
en Inglés
| MEDLINE | ID: mdl-22118829
17.
EasyModeller: A graphical interface to MODELLER.
BMC Res Notes
; 3: 226, 2010 Aug 16.
Artículo
en Inglés
| MEDLINE | ID: mdl-20712861
18.
Development of tools and database for analysis of metal binding sites in protein.
Protein Pept Lett
; 17(6): 765-73, 2010 Jun.
Artículo
en Inglés
| MEDLINE | ID: mdl-20205657
19.
An analysis of hydrophobic interactions of thymidylate synthase with methotrexate: free energy calculations involving mutant and native structures bound to methotrexate.
J Mol Model
; 16(2): 203-9, 2010 Feb.
Artículo
en Inglés
| MEDLINE | ID: mdl-19562390
20.
Identification of a developmentally and hormonally regulated Delta-Class glutathione S-transferase in rice moth Corcyra cephalonica.
Comp Biochem Physiol B Biochem Mol Biol
; 156(1): 33-9, 2010 May.
Artículo
en Inglés
| MEDLINE | ID: mdl-20138238