[HTML][HTML] Pharmacotherapeutic potential of natural products to target the SARS-CoV-2 PLpro using molecular screening and simulation approaches
AM Sayaf, H Ahmad, MA Aslam, SA Ghani… - Applied Biochemistry …, 2023 - Springer
Because of the essential role of PLpro in the regulation of replication and dysregulation of
the host immune sensing, it is considered a therapeutic target for novel drug development …
the host immune sensing, it is considered a therapeutic target for novel drug development …
[HTML][HTML] The role of IBV PL1pro in virus replication and suppression of host innate immune responses
W Liu, G Mu, Y Jia, M Yu, S Zhang, Z Wang… - BMC Veterinary …, 2023 - Springer
Background Coronavirus papain-like proteases (PLpros) play a crucial role in virus
replication and the evasion of the host immune response. Infectious bronchitis virus (IBV) …
replication and the evasion of the host immune response. Infectious bronchitis virus (IBV) …
In silico evaluation of S-adenosyl-L-homocysteine analogs as inhibitors of nsp14-viral cap N7 methyltranferase and PLpro of SARS-CoV-2: synthesis, molecular …
R Srivastava, SK Panda, PS Sen Gupta… - Journal of …, 2023 - Taylor & Francis
A series of S-adenosyl-L-homosysteine (SAH) analogs, with modification in the base and
sugar moiety, have been designed, synthesized and screened as nsp14 and PLpro …
sugar moiety, have been designed, synthesized and screened as nsp14 and PLpro …
Docking and other computing tools in drug design against SARS-CoV-2
AV Sulimov, IS Ilin, AS Tashchilova… - SAR and QSAR in …, 2024 - Taylor & Francis
The use of computer simulation methods has become an indispensable component in
identifying drugs against the SARS-CoV-2 coronavirus. There is a huge body of literature on …
identifying drugs against the SARS-CoV-2 coronavirus. There is a huge body of literature on …
Reconstruction of the unbinding pathways of new inhibitors of the SARS-CoV-2 papain-like protease using molecular dynamics simulation
P Rahebi, H Aryapour - Journal of Biomolecular Structure and …, 2023 - Taylor & Francis
Developing novel antiviral drugs against the SARS-CoV-2 virus and COVID-19 disease is
imperative as the vaccines may not offer absolute protection. PLpro plays a crucial role in …
imperative as the vaccines may not offer absolute protection. PLpro plays a crucial role in …
Covalent DNA-Encoded Library Workflow Drives Discovery of SARS-CoV-2 Non-structural Proteins Inhibitors
X Lu, H Hu, L Mei, X Wang, L Xiong, Y Zhu, S Liu… - bioRxiv, 2024 - biorxiv.org
The global coronavirus disease 2019 (COVID-19) pandemic persists, with the ongoing
mutation of the virus. Consequently, the development of inhibitors with diverse binding …
mutation of the virus. Consequently, the development of inhibitors with diverse binding …
Virtual screening of sulfur compounds of Allium against coronavirus proteases: E-Ajoene is a potential dual protease targeting covalent inhibitor
Mitigation of the activity of the main protease (Mpro) and papain-like protease (PLpro) of
SARS CoV-2 has direct implications in combating the ongoing deadly COVID-19 pandemic …
SARS CoV-2 has direct implications in combating the ongoing deadly COVID-19 pandemic …
[HTML][HTML] Identifying Drug Candidates for COVID-19 with Large-Scale Drug Screening
Papain-like protease (PLpro) is critical to COVID-19 infection. Therefore, it is a significant
target protein for drug development. We virtually screened a 26,193 compound library …
target protein for drug development. We virtually screened a 26,193 compound library …
In Silico Identification of Inhibitory Compounds for SARS-Cov-2 Papain-Like Protease
K Miwa, Y Guo, M Hata, Y Hirano… - Chemical and …, 2023 - jstage.jst.go.jp
Virtual screening with high-performance computers is a powerful and cost-effective
technique in drug discovery. A chemical database is searched to find candidate compounds …
technique in drug discovery. A chemical database is searched to find candidate compounds …
[HTML][HTML] A covalent inhibitor targeting the papain-like protease from SARS-CoV-2 inhibits viral replication
Covalent inhibitors of the papain-like protease (PLpro) from SARS-CoV-2 have great
potential as antivirals, but their non-specific reactivity with thiols has limited their …
potential as antivirals, but their non-specific reactivity with thiols has limited their …