Nogara PA - Search Results

1

In Silico Analysis of the Antidepressant Fluoxetine and Related Drugs at SARS-CoV-2 Main Protease (M^pro) and Papain-like Protease (PL^pro).

Tronco Pauletto PJ, Omage FB, Delgado CP, Nogara PA, Teixeira Rocha JB. Tronco Pauletto PJ, et al. Among authors: nogara pa. Curr Drug Discov Technol. 2023;20(2):e101022209771. doi: 10.2174/1570163819666221010115118. Curr Drug Discov Technol. 2023. PMID: 36221883

2

Chalcogen-mercury bond formation and disruption in model Rabenstein's reactions: A computational analysis.

Madabeni A, Dalla Tiezza M, Omage FB, Nogara PA, Bortoli M, Rocha JBT, Orian L. Madabeni A, et al. Among authors: nogara pa. J Comput Chem. 2020 Sep 5;41(23):2045-2054. doi: 10.1002/jcc.26371. Epub 2020 Jul 13. J Comput Chem. 2020. PMID: 32656797

3

In silico Studies on the Interaction between Mpro and PLpro From SARS-CoV-2 and Ebselen, its Metabolites and Derivatives.

Nogara PA, Omage FB, Bolzan GR, Delgado CP, Aschner M, Orian L, Teixeira Rocha JB. Nogara PA, et al. Mol Inform. 2021 Aug;40(8):e2100028. doi: 10.1002/minf.202100028. Epub 2021 May 21. Mol Inform. 2021. PMID: 34018687 Free PMC article.

4

Methylmercury Can Facilitate the Formation of Dehydroalanine in Selenoenzymes: Insight from DFT Molecular Modeling.

Nogara PA, Madabeni A, Bortoli M, Teixeira Rocha JB, Orian L. Nogara PA, et al. Chem Res Toxicol. 2021 Jun 21;34(6):1655-1663. doi: 10.1021/acs.chemrestox.1c00073. Epub 2021 Jun 2. Chem Res Toxicol. 2021. PMID: 34077192

5

In silico studies of M^pro and PL^pro from SARS-CoV-2 and a new class of cephalosporin drugs containing 1,2,4-thiadiazole.

Delgado CP, Rocha JBT, Orian L, Bortoli M, Nogara PA. Delgado CP, et al. Among authors: nogara pa. Struct Chem. 2022;33(6):2205-2220. doi: 10.1007/s11224-022-02036-5. Epub 2022 Sep 10. Struct Chem. 2022. PMID: 36106095 Free PMC article.

6

Reactivity and binding mode of disulfiram, its metabolites, and derivatives in SARS-CoV-2 PL^pro: insights from computational chemistry studies.

Nogara PA, Omage FB, Bolzan GR, Delgado CP, Orian L, Rocha JBT. Nogara PA, et al. J Mol Model. 2022 Oct 12;28(11):354. doi: 10.1007/s00894-022-05341-2. J Mol Model. 2022. PMID: 36222962 Free PMC article.

7

In silico analysis of the antidepressant fluoxetine and similar drugs as inhibitors of the human protein acid sphingomyelinase: a related SARS-CoV-2 inhibition pathway.

Pauletto P, Bortoli M, Bright FO, Delgado CP, Nogara PA, Orian L, da Rocha JBT. Pauletto P, et al. Among authors: nogara pa. J Biomol Struct Dyn. 2023 Nov;41(19):9562-9575. doi: 10.1080/07391102.2022.2148124. Epub 2022 Nov 29. J Biomol Struct Dyn. 2023. PMID: 36447407

8

Diphenyl Diselenide and SARS-CoV-2: in silico Exploration of the Mechanisms of Inhibition of Main Protease (M^pro) and Papain-like Protease (PL^pro).

Omage FB, Madabeni A, Tucci AR, Nogara PA, Bortoli M, Rosa ADS, Neuza Dos Santos Ferreira V, Teixeira Rocha JB, Miranda MD, Orian L. Omage FB, et al. Among authors: nogara pa. J Chem Inf Model. 2023 Apr 10;63(7):2226-2239. doi: 10.1021/acs.jcim.3c00168. Epub 2023 Mar 23. J Chem Inf Model. 2023. PMID: 36952618 Free PMC article.

9

1,2,3-Triazolo[4,5-b]aminoquinolines: Design, synthesis, structure, acetylcholinesterase (AChE) and butyrylcholinesterase (BChE) inhibitory activity, and molecular docking of novel modified tacrines.

Kappenberg YG, Nogara PA, Stefanello FS, Delgado CP, Rocha JBT, Zanatta N, Martins MAP, Bonacorso HG. Kappenberg YG, et al. Among authors: nogara pa. Bioorg Chem. 2023 Oct;139:106704. doi: 10.1016/j.bioorg.2023.106704. Epub 2023 Jul 6. Bioorg Chem. 2023. PMID: 37453239

10

In silico evidences of Mpro inhibition by a series of organochalcogen-AZT derivatives and their safety in Caenorhabditis elegans.

Viçozzi GP, de Oliveira Pereira FS, da Silva RS, Leal JG, Sarturi JM, Nogara PA, Rodrigues OED, Teixeira da Rocha JB, Ávila DS. Viçozzi GP, et al. Among authors: nogara pa. J Trace Elem Med Biol. 2023 Dec;80:127297. doi: 10.1016/j.jtemb.2023.127297. Epub 2023 Sep 1. J Trace Elem Med Biol. 2023. PMID: 37716209

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