Scior T - Search Results

1

Synthesis, in vitro and in vivo giardicidal activity of nitrothiazole-NSAID chimeras displaying broad antiprotozoal spectrum.

Colín-Lozano B, León-Rivera I, Chan-Bacab MJ, Ortega-Morales BO, Moo-Puc R, López-Guerrero V, Hernández-Núñez E, Argüello-Garcia R, Scior T, Barbosa-Cabrera E, Navarrete-Vázquez G. Colín-Lozano B, et al. Among authors: scior t. Bioorg Med Chem Lett. 2017 Aug 1;27(15):3490-3494. doi: 10.1016/j.bmcl.2017.05.071. Epub 2017 May 24. Bioorg Med Chem Lett. 2017. PMID: 28645659

2

Antiprotozoal Nitazoxanide Derivatives: Synthesis, Bioassays and QSAR Study Combined with Docking for Mechanistic Insight.

Scior T, Lozano-Aponte J, Ajmani S, Hernández-Montero E, Chávez-Silva F, Hernández-Núñez E, Moo-Puc R, Fraguela-Collar A, Navarrete-Vázquez G. Scior T, et al. Curr Comput Aided Drug Des. 2015;11(1):21-31. doi: 10.2174/1573409911666150414145937. Curr Comput Aided Drug Des. 2015. PMID: 25872791 Free PMC article.

3

Three-dimensional mapping of differential amino acids of human, murine, canine and equine TLR4/MD-2 receptor complexes conferring endotoxic activation by lipid A, antagonism by Eritoran and species-dependent activities of Lipid IVA in the mammalian LPS sensor system.

Scior T, Lozano-Aponte J, Figueroa-Vazquez V, Yunes-Rojas JA, Zähringer U, Alexander C. Scior T, et al. Comput Struct Biotechnol J. 2013 Aug 8;7:e201305003. doi: 10.5936/csbj.201305003. eCollection 2013. Comput Struct Biotechnol J. 2013. PMID: 24688739 Free PMC article.

4

Exploring electrostatic patterns of human, murine, equine and canine TLR4/MD-2 receptors.

Lozano-Aponte J, Scior T, Ambrosio FNM, González-Melchor M, Alexander C. Lozano-Aponte J, et al. Among authors: scior t. Innate Immun. 2020 Jul;26(5):364-380. doi: 10.1177/1753425919894628. Epub 2019 Dec 25. Innate Immun. 2020. PMID: 31874581 Free PMC article.

5

Five Novel Non-Sialic Acid-Like Scaffolds Inhibit In Vitro H1N1 and H5N2 Neuraminidase Activity of Influenza a Virus.

Márquez-Domínguez L, Reyes-Leyva J, Herrera-Camacho I, Santos-López G, Scior T. Márquez-Domínguez L, et al. Among authors: scior t. Molecules. 2020 Sep 16;25(18):4248. doi: 10.3390/molecules25184248. Molecules. 2020. PMID: 32947893 Free PMC article.

6

Mefloquine inhibits voltage dependent Na_v1.4 channel by overlapping the local anaesthetic binding site.

Paiz-Candia B, Islas AA, Sánchez-Solano A, Mancilla-Simbro C, Scior T, Millan-PerezPeña L, Salinas-Stefanon EM. Paiz-Candia B, et al. Among authors: scior t. Eur J Pharmacol. 2017 Feb 5;796:215-223. doi: 10.1016/j.ejphar.2017.01.002. Epub 2017 Jan 3. Eur J Pharmacol. 2017. PMID: 28057491

7

Induced fit, ensemble binding space docking and Monte Carlo simulations of MDMA 'ecstasy' and 3D pharmacophore design of MDMA derivatives on the human serotonin transporter (hSERT).

Islas ÁA, Moreno LG, Scior T. Islas ÁA, et al. Among authors: scior t. Heliyon. 2021 Aug 13;7(8):e07784. doi: 10.1016/j.heliyon.2021.e07784. eCollection 2021 Aug. Heliyon. 2021. PMID: 34458620 Free PMC article.

8

Induced fit for cytochrome P450 3A4 based on molecular dynamics.

Quiroga I, Scior T. Quiroga I, et al. Among authors: scior t. ADMET DMPK. 2019 Dec 11;7(4):252-266. doi: 10.5599/admet.729. eCollection 2019. ADMET DMPK. 2019. PMID: 35359616 Free PMC article.

9

Allosteric Binding of MDMA to the Human Serotonin Transporter (hSERT) via Ensemble Binding Space Analysis with ΔG Calculations, Induced Fit Docking and Monte Carlo Simulations.

Islas ÁA, Scior T. Islas ÁA, et al. Among authors: scior t. Molecules. 2022 May 6;27(9):2977. doi: 10.3390/molecules27092977. Molecules. 2022. PMID: 35566327 Free PMC article.

10

Predicting a double mutant in the twilight zone of low homology modeling for the skeletal muscle voltage-gated sodium channel subunit beta-1 (Nav1.4 β1).

Scior T, Paiz-Candia B, Islas ÁA, Sánchez-Solano A, Millan-Perez Peña L, Mancilla-Simbro C, Salinas-Stefanon EM. Scior T, et al. Comput Struct Biotechnol J. 2015 Mar 27;13:229-40. doi: 10.1016/j.csbj.2015.03.005. eCollection 2015. Comput Struct Biotechnol J. 2015. PMID: 25904995 Free PMC article.

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