Gautier Moroy
Gautier Moroy
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Toward in silico structure-based ADMET prediction in drug discovery
G Moroy, VY Martiny, P Vayer, BO Villoutreix, MA Miteva
Drug discovery today 17 (1-2), 44-55, 2012
Neutrophil elastase as a target in lung cancer
G Moroy, A JP Alix, J Sapi, W Hornebeck, E Bourguet
Anti-Cancer Agents in Medicinal Chemistry (Formerly Current Medicinal …, 2012
PEP-SiteFinder: a tool for the blind identification of peptide binding sites on protein surfaces
A Saladin, J Rey, P Thévenet, M Zacharias, G Moroy, P Tufféry
Nucleic acids research 42 (W1), W221-W226, 2014
A fibrillin-1-fragment containing the elastin-binding-protein GxxPG consensus sequence upregulates matrix metalloproteinase-1: biochemical and computational analysis
P Booms, A Ney, F Barthel, G Moroy, D Counsell, C Gille, G Guo, R Pregla, ...
Journal of molecular and cellular cardiology 40 (2), 234-246, 2006
Introduction of the 4-(4-bromophenyl) benzenesulfonyl group to hydrazide analogs of Ilomastat leads to potent gelatinase B (MMP-9) inhibitors with improved selectivity
G LeDour, G Moroy, M Rouffet, E Bourguet, D Guillaume, M Decarme, ...
Bioorganic & medicinal chemistry 16 (18), 8745-8759, 2008
Molecular basis for Bcl-2 homology 3 domain recognition in the Bcl-2 protein family: identification of conserved hot spot interactions
G Moroy, E Martin, A Dejaegere, RH Stote
Journal of Biological Chemistry 284 (26), 17499-17511, 2009
Structural characterization of human elastin derived peptides containing the GXXP sequence
G Moroy, AJP Alix, S Héry‐Huynh
Biopolymers: Original Research on Biomolecules 78 (4), 206-220, 2005
Integrated structure- and ligand-based in silico approach to predict inhibition of cytochrome P450 2D6
VY Martiny, P Carbonell, F Chevillard, G Moroy, AB Nicot, P Vayer, ...
Bioinformatics 31 (24), 3930-3937, 2015
A rational free energy-based approach to understanding and targeting disease-causing missense mutations
Z Zhang, S Witham, M Petukh, G Moroy, M Miteva, Y Ikeguchi, E Alexov
Journal of the American Medical Informatics Association 20 (4), 643-651, 2013
Simultaneous presence of unsaturation and long alkyl chain at P1′ of Ilomastat confers selectivity for gelatinase A (MMP-2) over gelatinase B (MMP-9) inhibition as shown by …
G Moroy, C Denhez, H El Mourabit, A Toribio, A Dassonville, M Decarme, ...
Bioorganic & medicinal chemistry 15 (14), 4753-4766, 2007
In silico mechanistic profiling to probe small molecule binding to sulfotransferases
VY Martiny, P Carbonell, D Lagorce, BO Villoutreix, G Moroy, MA Miteva
PLoS One 8 (9), e73587, 2013
Sampling of conformational ensemble for virtual screening using molecular dynamics simulations and normal mode analysis
G Moroy, O Sperandio, S Rielland, S Khemka, K Druart, D Goyal, ...
Future medicinal chemistry 7 (17), 2317-2331, 2015
Class I HDAC inhibitors: potential new epigenetic therapeutics for alcohol use disorder (AUD)
E Bourguet, K Ozdarska, G Moroy, J Jeanblanc, M Naassila
Journal of Medicinal Chemistry 61 (5), 1745-1766, 2017
JNK contributes to Hif-1α regulation in hypoxic neurons
X Antoniou, A Sclip, C Ploia, A Colombo, G Moroy, T Borsello
Molecules 15 (1), 114-127, 2009
A proposed interaction mechanism between elastin‐derived peptides and the elastin/laminin receptor‐binding domain
G Moroy, A Ostuni, A Pepe, AM Tamburro, AJP Alix, S Héry‐Huynh
Proteins: Structure, Function, and Bioinformatics 76 (2), 461-476, 2009
Dihydroisocoumarin glucosides from stem bark of Caryocar glabrum
AA Magid, L Voutquenne-Nazabadioko, G Moroy, C Moretti, C Lavaud
Phytochemistry 68 (19), 2439-2443, 2007
Molecular Rescue of Dyrk1A Overexpression Alterations in Mice with Fontup® Dietary Supplement: Role of Green Tea Catechins
Y Gu, G Moroy, JL Paul, AS Rebillat, M Dierssen, R de la Torre, ...
International Journal of Molecular Sciences 21 (4), 1404, 2020
Inhibition of human leukocyte elastase, plasmin and matrix metalloproteinases by oleic acid and oleoyl-galardin derivative (s)
G Moroy, E Bourguet, M Decarme, J Sapi, AJP Alix, W Hornebeck, ...
Biochemical pharmacology 81 (5), 626-635, 2011
Anticancer Agents Med
G Moroy, AJ Alix, J Sapi, W Hornebeck, E Bourguet
Chem 12, 565-579, 2012
Four major channels detected in the cytochrome P450 3A4: a step toward understanding its multispecificity
L Benkaidali, F André, G Moroy, B Tangour, F Maurel, M Petitjean
International Journal of Molecular Sciences 20 (4), 987, 2019
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