Fernández-de Gortari E - Search Results

1

An in silico pipeline for the discovery of multitarget ligands: A case study for epi-polypharmacology based on DNMT1/HDAC2 inhibition.

Prieto-Martínez FD, Fernández-de Gortari E, Medina-Franco JL, Espinoza-Fonseca LM. Prieto-Martínez FD, et al. Among authors: fernandez de gortari e. Artif Intell Life Sci. 2021 Dec;1:100008. doi: 10.1016/j.ailsci.2021.100008. Epub 2021 Sep 12. Artif Intell Life Sci. 2021. PMID: 35475037 Free PMC article.

2

Developmental DNA methyltransferase inhibitors in the treatment of gynecologic cancers.

Duenas-Gonzalez A, Medina-Franco JL, Chavez-Blanco A, Dominguez-Gomez G, Fernández-de Gortari E. Duenas-Gonzalez A, et al. Expert Opin Pharmacother. 2016;17(3):323-38. doi: 10.1517/14656566.2016.1118053. Epub 2015 Dec 17. Expert Opin Pharmacother. 2016. PMID: 26559668 Review.

3

Design and synthesis of N-benzoyl amino acid derivatives as DNA methylation inhibitors.

Garella D, Atlante S, Borretto E, Cocco M, Giorgis M, Costale A, Stevanato L, Miglio G, Cencioni C, Fernández-de Gortari E, Medina-Franco JL, Spallotta F, Gaetano C, Bertinaria M. Garella D, et al. Chem Biol Drug Des. 2016 Nov;88(5):664-676. doi: 10.1111/cbdd.12794. Epub 2016 Jun 24. Chem Biol Drug Des. 2016. PMID: 27225604

4

Molecular Modeling and Chemoinformatics to Advance the Development of Modulators of Epigenetic Targets: A Focus on DNA Methyltransferases.

Prieto-Martínez FD, Peña-Castillo A, Méndez-Lucio O, Fernández-de Gortari E, Medina-Franco JL. Prieto-Martínez FD, et al. Adv Protein Chem Struct Biol. 2016;105:1-26. doi: 10.1016/bs.apcsb.2016.05.001. Epub 2016 Jun 14. Adv Protein Chem Struct Biol. 2016. PMID: 27567482 Review.

5

Database fingerprint (DFP): an approach to represent molecular databases.

Fernández-de Gortari E, García-Jacas CR, Martinez-Mayorga K, Medina-Franco JL. Fernández-de Gortari E, et al. J Cheminform. 2017 Feb 6;9:9. doi: 10.1186/s13321-017-0195-1. eCollection 2017. J Cheminform. 2017. PMID: 28224019 Free PMC article.

6

Preexisting domain motions underlie protonation-dependent structural transitions of the P-type Ca²⁺-ATPase.

Fernández-de Gortari E, Espinoza-Fonseca LM. Fernández-de Gortari E, et al. Phys Chem Chem Phys. 2017 Apr 12;19(15):10153-10162. doi: 10.1039/c7cp00243b. Phys Chem Chem Phys. 2017. PMID: 28374038 Free PMC article.

7

Structural basis for relief of phospholamban-mediated inhibition of the sarcoplasmic reticulum Ca²⁺-ATPase at saturating Ca²⁺ conditions.

Fernández-de Gortari E, Espinoza-Fonseca LM. Fernández-de Gortari E, et al. J Biol Chem. 2018 Aug 10;293(32):12405-12414. doi: 10.1074/jbc.RA118.003752. Epub 2018 Jun 22. J Biol Chem. 2018. PMID: 29934304 Free PMC article.

8

Structural Basis for the Limited Response to Oxidative and Thiol-Conjugating Agents by Triosephosphate Isomerase From the Photosynthetic Bacteria Synechocystis.

Castro-Torres E, Jimenez-Sandoval P, Fernández-de Gortari E, López-Castillo M, Baruch-Torres N, López-Hidalgo M, Peralta-Castro A, Díaz-Quezada C, Sotelo-Mundo RR, Benitez-Cardoza CG, Espinoza-Fonseca LM, Ochoa-Leyva A, Brieba LG. Castro-Torres E, et al. Front Mol Biosci. 2018 Nov 27;5:103. doi: 10.3389/fmolb.2018.00103. eCollection 2018. Front Mol Biosci. 2018. PMID: 30538993 Free PMC article.

9

Conserved Luminal C-Terminal Domain Dynamically Controls Interdomain Communication in Sarcolipin.

Aguayo-Ortiz R, Fernández-de Gortari E, Espinoza-Fonseca LM. Aguayo-Ortiz R, et al. Among authors: fernandez de gortari e. J Chem Inf Model. 2020 Aug 24;60(8):3985-3991. doi: 10.1021/acs.jcim.0c00418. Epub 2020 Jul 27. J Chem Inf Model. 2020. PMID: 32668157 Free PMC article.

10

Rationality over fashion and hype in drug design.

Medina-Franco JL, Martinez-Mayorga K, Fernández-de Gortari E, Kirchmair J, Bajorath J. Medina-Franco JL, et al. Among authors: fernandez de gortari e. F1000Res. 2021 May 18;10:Chem Inf Sci-397. doi: 10.12688/f1000research.52676.1. eCollection 2021. F1000Res. 2021. PMID: 34164109 Free PMC article.

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