SARS-CoV-2 papain-like protease potential inhibitors—in silico quantitative assessment

A Stasiulewicz, AW Maksymiuk, ML Nguyen… - International journal of …, 2021 - mdpi.com
Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) encodes the papain-like
protease (PLpro). The protein not only plays an essential role in viral replication but also …

In Silico Elucidation of Potent Inhibitors and Rational Drug Design against SARS-CoV-2 Papain-like Protease

K Sanachai, P Mahalapbutr… - The Journal of …, 2021 - ACS Publications
Global public health has been a critical problem by the sudden increase of the COVID-19
outbreak. The papain-like protease (PLpro) of SARS-CoV-2 is a key promising target for …

Discovery of potential SARS-CoV-2 papain-like protease natural inhibitors employing a multi-phase in silico approach

EB Elkaeed, AM Metwaly, MS Alesawy, AM Saleh… - Life, 2022 - mdpi.com
As an extension of our research against COVID-19, a multiphase in silico approach was
applied in the selection of the three most common inhibitors (Glycyrrhizoflavone (76) …

Potential COVID-19 papain-like protease PLpro inhibitors: repurposing FDA-approved drugs

VL Kouznetsova, A Zhang, M Tatineni, MA Miller… - PeerJ, 2020 - peerj.com
Using the crystal structure of SARS-CoV-2 papain-like protease (PL pro) as a template, we
developed a pharmacophore model of functional centers of the PL pro inhibitor-binding …

Repurposing known drugs as covalent and non-covalent inhibitors of the SARS-CoV-2 papain-like protease

P Delre, F Caporuscio, M Saviano… - Frontiers in …, 2020 - frontiersin.org
In the absence of an approved vaccine, developing effective severe acute respiratory
syndrome coronavirus 2 (SARS-CoV-2) antivirals is essential to tackle the current pandemic …

[HTML][HTML] Discovery of human coronaviruses pan-papain-like protease inhibitors using computational approaches

MA Alamri, MT ul Qamar, MU Mirza… - Journal of …, 2020 - Elsevier
The papain-like protease (PL pro) is vital for the replication of coronaviruses (CoVs), as well
as for escaping innate-immune responses of the host. Hence, it has emerged as an …

Large-scale virtual screening for the discovery of SARS-CoV-2 papain-like protease (PLpro) non-covalent inhibitors

O Garland, AT Ton, S Moradi, JR Smith… - Journal of Chemical …, 2023 - ACS Publications
The rapid global spread of the SARS-CoV-2 virus facilitated the development of novel direct-
acting antiviral agents (DAAs). The papain-like protease (PLpro) has been proposed as one …

Identification of Small Molecule Inhibitors of the Deubiquitinating Activity of the SARS-CoV-2 Papain-Like Protease: in silico Molecular Docking Studies and in vitro …

E Pitsillou, J Liang, K Ververis, KW Lim, A Hung… - Frontiers in …, 2020 - frontiersin.org
COVID-19 is an ongoing pandemic caused by the SARS-CoV-2 virus with important political,
socio-economic, and public health consequences. Inhibiting replication represents an …

In silico Exploration of Inhibitors for SARS-CoV-2's Papain-Like Protease

T Huynh, W Cornell, B Luan - Frontiers in chemistry, 2021 - frontiersin.org
Coronavirus disease 2019 (COVID-19) is an ongoing global pandemic caused by severe
acute respiratory syndrome coronavirus 2 (SARS-CoV-2), with very limited treatments so far …

Structure-Based Screening to Discover New Inhibitors for Papain-like Proteinase of SARS-CoV-2: An In Silico Study

M Jamalan, E Barzegari… - Journal of proteome …, 2020 - ACS Publications
Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) expresses a
multifunctional papain-like proteinase (PLpro), which mediates the processing of the viral …