Literature DB >> 31634019

Drug Repurposing Approach for Developing Novel Therapy Against Mupirocin-Resistant Staphylococcus aureus.

Somdutt Mujwar1, Rohitas Deshmukh1, Ranjit K Harwansh1, Jeetendra Kumar Gupta1, Alekh Gour2.   

Abstract

Multidrug resistance (MDR) is a major health issue for the treatment of infectious diseases throughout the world. Staphylococcus aureus (S. aureus) is a Gram-positive bacteria, responsible for various local and systemic infections in humans. The continuous and abrupt use of antibiotics against bacteria such as S. aureus results in the development of resistant strains. Presently, mupirocin (MUP) is the drug of choice against S. aureus and MDR (methicillin-resistant). However, S. aureus has acquired resistance against MUP as well due to isoleucyl-tRNA synthetase (IleS) mutation at sites 588 and 631. Thus, the aim of the present study was to discover novel bioactives against MUP-resistant S. aureus using in silico drug repurposing approaches. In silico drug repurposing techniques were used to obtain suitable bioactive lead molecules such as buclizine, tasosartan, emetine, medrysone, and so on. These lead molecules might be able to resolve this issue. These leads were obtained through molecular docking simulation based virtual screening, which could be promising for the treatment of MUP-resistant S. aureus. The findings of the present work need to be validated further through in vitro and in vivo studies for their clinical application.

Entities:  

Keywords:  Staphylococcus aureus; buclizine; drug repositioning; drug repurposing; mupirocin; resistance

Year:  2019        PMID: 31634019     DOI: 10.1089/adt.2019.944

Source DB:  PubMed          Journal:  Assay Drug Dev Technol        ISSN: 1540-658X            Impact factor:   1.738


  8 in total

Review 1.  The crafty opponent: the defense systems of Staphylococcus aureus and response measures.

Authors:  Hongjie Hou; Yang Li; Yuefei Jin; Shuaiyin Chen; Jinzhao Long; Guangcai Duan; Haiyan Yang
Journal:  Folia Microbiol (Praha)       Date:  2022-02-12       Impact factor: 2.099

2.  The promising anti-virulence activity of candesartan, domperidone, and miconazole on Staphylococcus aureus.

Authors:  Amira M El-Ganiny; Amany I Gad; Mona A El-Sayed; Moataz A Shaldam; Hisham A Abbas
Journal:  Braz J Microbiol       Date:  2021-11-13       Impact factor: 2.476

3.  Preparation of Novel Pyrazolo[4,3-e]tetrazolo[1,5-b][1,2,4]triazine Sulfonamides and Their Experimental and Computational Biological Studies.

Authors:  Mateusz Kciuk; Somdutt Mujwar; Anna Szymanowska; Beata Marciniak; Karol Bukowski; Mariusz Mojzych; Renata Kontek
Journal:  Int J Mol Sci       Date:  2022-05-24       Impact factor: 6.208

4.  Repurposing benzbromarone as antifolate to develop novel antifungal therapy for Candida albicans.

Authors:  Somdutt Mujwar; Avanish Tripathi
Journal:  J Mol Model       Date:  2022-06-18       Impact factor: 2.172

5.  Discovery of adapalene and dihydrotachysterol as antiviral agents for the Omicron variant of SARS-CoV-2 through computational drug repurposing.

Authors:  Ozkan Fidan; Somdutt Mujwar; Mateusz Kciuk
Journal:  Mol Divers       Date:  2022-05-04       Impact factor: 3.364

6.  In silico evaluation of food-derived carotenoids against SARS-CoV-2 drug targets: Crocin is a promising dietary supplement candidate for COVID-19.

Authors:  Somdutt Mujwar; Lei Sun; Ozkan Fidan
Journal:  J Food Biochem       Date:  2022-05-11       Impact factor: 3.654

7.  Computational screening for investigating the synergistic regulatory potential of drugs and phytochemicals in combination with 2-deoxy-D-glucose against SARS-CoV-2.

Authors:  Anshika Gupta; Shweta Singh Chauhan; Anamika Singh Gaur; Ramakrishnan Parthasarathi
Journal:  Struct Chem       Date:  2022-09-03       Impact factor: 1.795

Review 8.  Quinoline derivatives volunteering against antimicrobial resistance: rational approaches, design strategies, structure activity relationship and mechanistic insights.

Authors:  Nitish Kumar; Aanchal Khanna; Komalpreet Kaur; Harmandeep Kaur; Anchal Sharma; Preet Mohinder Singh Bedi
Journal:  Mol Divers       Date:  2022-10-05       Impact factor: 3.364

  8 in total

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