Amentoflavone derivatives significantly act towards the main protease (3CLPRO/MPRO) of SARS-CoV-2: in silico admet profiling, molecular docking, molecular dynamics simulation, network pharmacology

Author:

Dey Dipta,Hossain Rajib,Biswas ParthaORCID,Paul Priyanka,Islam Md. Aminul,Ema Tanzila Ismail,Gain Bibhuti Kumar,Hasan Mohammad Mehedi,Bibi Shabana,Islam Muhammad Torequl,Rahman Md. Ataur,Kim Bonglee

Funder

National Research Foundation of Korea

Korean Institute of Oriental Medicine

Korea Health Industry Development Institute

Ministry of Health & Welfare, Republic of Korea

Publisher

Springer Science and Business Media LLC

Subject

Inorganic Chemistry,Organic Chemistry,Physical and Theoretical Chemistry,Drug Discovery,Molecular Biology,General Medicine,Information Systems,Catalysis

Reference74 articles.

1. Biswas P, Hasan MM, Dey D, Dos Santos Costa AC, Polash SA, Bibi S, Ferdous N, Kaium MA, Rahman MDH, Jeet FK et al (2021) Candidate antiviral drugs for COVID-19 and their environmental implications: a comprehensive analysis. Environ Sci Pollut Res Int. https://doi.org/10.1007/s11356-021-16096-3

2. Sharif MA, Hossen MS, Shaikat MM, Mashuk F, Haidary TIE, Dey D, Paul PK, Al Azad S, Al Mazid MF, Badal MNU (2021) Molecular optimization, docking and dynamic simulation study of selective natural aromatic components to block E2-CD81 complex formation in predating protease inhibitor resistant HCV influx. Int J Pharm Res 13:3511–3525

3. Rahman M, Zilani M, Hasan N, Islam M, Hasan M, Yasmin F, Biswas P, Hirashima A, Kim B (2021) In vivo neuropharmacological potential of Gomphandra Tetrandra (wall) Sleumer and in-silico study against β-amyloid precursor protein. Processes. https://doi.org/10.3390/pr9081449

4. Chan JF, Lau SK, To KK, Cheng VC, Woo PC, Yuen KY (2015) Middle East respiratory syndrome coronavirus: another zoonotic betacoronavirus causing SARS-like disease. Clin Microbiol Rev 28:465–522. https://doi.org/10.1128/cmr.00102-14

5. Dey D, Paul PK, Al Azad S, Al Mazid MF, Khan AM, Sharif MA, Rahman MH (2021) Molecular optimization, docking, and dynamic simulation profiling of selective aromatic phytochemical ligands in blocking the SARS-CoV-2 S protein attachment to ACE2 receptor: an in silico approach of targeted drug designing. J Adv Vet Anim Res 8:24–35. https://doi.org/10.5455/javar.2021.h481

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