<i>In silico</i> analysis of the antidepressant fluoxetine and similar drugs as inhibitors of the human protein acid sphingomyelinase: a related SARS-CoV-2 inhibition pathway-Reference-Cited by-同舟云学术

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

Published:2022-11-29 Issue: Volume: Page:1-14
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Pauletto Pedro¹^ORCID,Bortoli Marco²^ORCID,Bright Folorunsho Omage¹^ORCID,Delgado Cássia Pereira¹^ORCID,Nogara Pablo Andrei¹,Orian Laura³^ORCID,da Rocha João Batista Teixeira¹^ORCID

Affiliation:

1. Departamento de Bioquímica e Biologia Molecular, Universidade Federal de Santa Maria (UFSM), Santa Maria, RS, Brazil

2. Institut de Química Computacional i Catàlisi (IQCC) i Departament de Química, Facultat de Ciències, Universitat de Girona, Girona, Spain

3. Dipartimento di Scienze Chimiche, Università degli Studi di Padova, Padova, Italy

Funder

CNPq (Conselho Nacional de Desenvolvimento Científico e Tecnológico) and Coordination for Improvement of Higher Education Personnel CAPES/PROEX

CAPES

Department of Chemical Sciences of the University of Padova

CNAF center of the Italian institute of Nuclear Physics

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2022.2148124

Reference53 articles.

1. Clinical Pharmacokinetics of Fluoxetine

2. Fluoxetine and norfluoxetine plasma concentrations in major depression: a multicenter study

3. H++ 3.0: automating pK prediction and the preparation of biomolecular structures for atomistic molecular modeling and simulations

4. Sphingomyelin: biophysical aspects

5. Pharmacological Inhibition of Acid Sphingomyelinase Prevents Uptake of SARS-CoV-2 by Epithelial Cells

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1. Repurposing FIASMAs against Acid Sphingomyelinase for COVID-19: A Computational Molecular Docking and Dynamic Simulation Approach;Molecules;2023-03-27

2. Acid sphingomyelinase (ASM) and COVID‐19: A review of the potential use of ASM inhibitors against SARS‐CoV‐2;Cell Biochemistry and Function;2023-03-17