Potential Papain-like Protease Inhibitors Against COVID-19: A Comprehensive In Silico Based Review

被引:3
|
作者
Agrawal, Neetu [1 ]
Pathak, Shilpi [1 ]
Goyal, Ahsas [1 ]
机构
[1] GLA Univ, Pharmaceut Res Inst, Mathura 281406, Uttar Pradesh, India
关键词
COVID-19; SARS-CoV-2; Papain-like protease; PLpro; in silico; molecular docking;
D O I
10.2174/1386207325666211122123602
中图分类号
Q5 [生物化学];
学科分类号
071010 ; 081704 ;
摘要
The entire world has been in a battle against the COVID-19 pandemic since its first appearance in December 2019. Thus researchers are desperately working to find an effective and safe therapeutic agent for its treatment. The multifunctional coronavirus enzyme papain-like protease (PLpro) is a potential target for drug discovery to combat the ongoing pandemic responsible for cleavage of the polypeptide, deISGylation, and suppression of host immune response. The present review collates the in silico studies performed on various FDA-approved drugs, chemical compounds, and phytochemicals from various drug databases and represents the compounds possessing the potential to inhibit PLpro. Thus this review can provide quick access to a potential candidate to medicinal chemists to perform in vitro and in vivo experiments who are thriving to find the effective agents for the treatment of COVID-19.
引用
收藏
页码:1838 / 1858
页数:21
相关论文
共 50 条
  • [41] Investigation of the interactions of HSA and SARS-CoV-2 papain-like protease against eugenol for novel COVID-19 drug discovery: spectroscopic and insilico study
    Naz, Farheen
    Khan, Imran
    Baammi, Soukayna
    Islam, Asimul
    JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2023, 41 (19): : 10161 - 10170
  • [42] Identification of novel allosteric sites of SARS-CoV-2 papain-like protease (PLpro) for the development of COVID-19 antivirals
    Ferreira, Juliana C.
    Villanueva, Adrian J.
    Al Adem, Kenana
    Fadl, Samar
    Alzyoud, Lara
    Ghattas, Mohammad A.
    Rabeh, Wael M.
    JOURNAL OF BIOLOGICAL CHEMISTRY, 2024, 300 (11)
  • [43] Swertiamarin and sweroside are potential inhibitors of COVID-19 based on the silico analysis
    Wang, Wenxiang
    Tan, Ying
    Mao, Jingxin
    Xiong, Wei
    MEDICINE, 2024, 103 (45)
  • [44] Potential Inhibitors Targeting Papain-Like Protease of SARS-CoV-2: Two Birds With One Stone
    Jiang, Haihai
    Yang, Peiyao
    Zhang, Jin
    FRONTIERS IN CHEMISTRY, 2022, 10
  • [45] Identification of potential SARS-CoV-2 papain-like protease inhibitors with the ability to interact with the catalytic triad
    Muhammad, Murtala
    Habib, I. Y.
    Yunusa, Abdulmumin
    Mikail, Tasiu A.
    ALhassan, A. J.
    Alkhatib, Ahed J.
    Sule, Hamza
    Ismail, Sagir Y.
    Liu, Dong
    AIMS BIOPHYSICS, 2023, 10 (01): : 50 - 66
  • [46] Can Papain-like Protease Inhibitors Halt SARS-CoV-2 Replication?
    Maiti, Biplab K.
    ACS PHARMACOLOGY & TRANSLATIONAL SCIENCE, 2020, 3 (05) : 1017 - 1019
  • [47] Structure-Based Design of Covalent SARS-CoV-2 Papain-like Protease Inhibitors
    Tan, Bin
    Liang, Xueying
    Ansari, Ahmadullah
    Jadhav, Prakash
    Tan, Haozhou
    Li, Kan
    Ruiz, Francesc Xavier
    Arnold, Eddy
    Deng, Xufang
    Wang, Jun
    JOURNAL OF MEDICINAL CHEMISTRY, 2024, 67 (22) : 20399 - 20420
  • [48] Chemical screen uncovers novel structural classes of inhibitors of the papain-like protease of coronaviruses
    Jeong, Kwiwan
    Kim, Jinhee
    Chang, JuOae
    Hong, Subin
    Kim, Inseo
    Oh, Sunghyun
    Jeon, Sangeun
    Lee, Joo Chan
    Park, Hyun-Ju
    Kim, Seungtaek
    Lee, Wonsik
    ISCIENCE, 2022, 25 (10)
  • [49] Novel Papain-Like Protease Inhibitors for Treating Viral Infections, in Particular Coronavirus Infections
    Sabnis, Ram W.
    ACS MEDICINAL CHEMISTRY LETTERS, 2024, 15 (11): : 1802 - 1803
  • [50] Review of the crystallized structures of the SARS-CoV-2 papain-like protease
    Qiu, Yue
    Jiang, Hua-Juan
    Yang, Yu-Shun
    Hu, Xiao-Qin
    Zeng, Xue-Wen
    JOURNAL OF MOLECULAR STRUCTURE, 2025, 1333