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Simeprevir and Eltrombopag as Potential Inhibitors of SARS-CoV2 Proteases: A Molecular Docking and Virtual Screening Approach to Combat COVID-19

21 September 2020, Version 1
Working Paper
This content is a preprint and has not undergone peer review at the time of posting.

Abstract

The present study investigates the binding affinities of 61 FDA approved drugs against two key proteases of SARS-COV2, 3-chymotrypsin-like protease and papain-like protease. We also investigated the ADMET properties of the top 10 best binding drugs to understand the druglikeness property.

Keywords

Simeprevir
Eltrombopag
COVID-19
SARS-CoV2
Proteases
Docking
ADMET

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Version History

Sep 21, 2020 Version 1

Version Notes

Final draft

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License

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The content is available under CC BY NC ND 4.0 [opens in a new tab]

DOI

10.26434/chemrxiv.12980306.v1
D O I: 10.26434/chemrxiv.12980306.v1 [opens in a new tab]

Funding

The present study do not have any specific funding

Author’s competing interest statement

Author do not have any conflict of interest

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