International Journal of Pharmacy and Drug Research.
Volume 2, Number 1 (2013), pp. 1-10
© Research India Publications
http://www.ripublication.com/ijpdr.htm
Comparitive Study of Various Ebola Virus Vp40
Strains with Modelling and Docking Studies to Treat
Ebola Virus Infection
Jigar Patel, Yashodhan Chipkar and Afaque Momin
Department of Bioinformatics, GNIRD,
Guru Nanak Khalsa College, Mumbai, India.
Email:-Jigar.patel3112@gmail.com.
Abstract:
Computer aided drug design is one of the powerful toolsfor discovering new
drug leads against important targets. The Ebolavirus is a naturally resistant
virus to various antibiotics, and there is noproper treatment for infection
caused by this pathogen, hence there is a need for new drugs and approaches
tocombat the life threatening infection caused by Ebola virus. The viral protein
vp40 is capable of eliciting protective immuneresponses to EBOV. The
various functions of these proteins in pathogenesis suggested them as potential
drugtargets to control EBOV infections.
In this work, the VP 40 protein sequences were selected from different
countries and a multiple sequence analysis was performed to find out the
homology between sequences. Three sequences were chosen which were
homolog’s of each other and the leads were designed which would act on all
the three strains. New leads were designed which scored well when docked
against targets. The drug lead molecules were evaluated for their drug likeness
using “Lipinski rule of five”. The identification of appropriate drug lead
molecules against these proteins has lead to a successful drug candidate
against Ebola virus infection.
Keywords: Ebola virus, Hemorrhagic fever, Computer aided drug design,
multiple sequence analysis, Lipinski rule of five.
INTRODUCTION:
Ebola virus is a deadly pathogenic virus. It is classified under filoviridea family. It
was first identified in Africa in1976 in The Democratic Republic of Congo.