Identification of new inhibitors of NS5 from dengue virus using saturation transfer difference (STD-NMR) and molecular docking studies

Author:

Ullah Asmat1ORCID,Atia-tul-Wahab 1ORCID,Gong Peng2,Khan Abdul Mateen3ORCID,Choudhary M. Iqbal134ORCID

Affiliation:

1. Dr Panjwani Center for Molecular Medicine and Drug Research, International Center of Chemical and Biological Sciences, University of Karachi, Karachi, 75270, Pakistan

2. Wuhan Institute of Virology, Chinese Academy of Sciences, Wuhan, Hubei 430071, China

3. H.E.J. Research Institute of Chemistry, International Center for Chemical and Biological Sciences, University of Karachi, Karachi, 75270, Pakistan

4. Department of Biochemistry, Faculty of Science, King Abdulaziz University, Jeddah-21589, Saudi Arabia

Abstract

This article presents results obtained from STD-NMR and molecular docking studies to examine the interaction of US-FDA approved drugs as well as natural compounds against the NS5 protein from dengue virus.

Funder

Higher Education Commission, Pakistan

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

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