18 / 27
Page 74
allied
academies
J Pharmacol Ther Res 2017 Volume 1 Issue 2
November 02-03, 2017 Chicago, USA
4
th
International Congress on
International Conference and Exhibition on
Drug Discovery, Designing and Development
Biochemistry, Molecular Biology: R&D
&
W
e have efficient group based quantitative structure–
activity relationships (G-QSAR). Exploring the
relationship between the structures of a new promising
family of 2- phenazinamine derivatives and their anticancer
activities. We have residential evocative model, to aid in
further optimization and expansion of newer anticancer
agents containing pharmacophore. G-QSAR was performed
on VLife molecular design suite (MDS) 4.2 version software.
The extrapolative authority of the G-QSAR was checked
through the cross-validation method and by separation
some compounds as fraction of external test set. Synthesis
of 5 novel derivatives 2- phenazinamine derivative by using
result of GQSAR and screening of
in vitro
anticancer activity
on K562 cell line was done in Tata Memorial Cancer Research
Center Mumbai, India, showing improve anticancer activity.
Phenazinamine and the analogues have better binding
interactions with Oxidoreductase (PDB: 1YYD.) The binding
energies of the protein-ligand interactions also confirm that
the ligands are fit into the active pockets of receptor tightly.
Docking perform in Autodock 4.2 version software.
e:
sonwane.gajanan@rediffmail.comApplication of computer aided drug design strategies for optimization of anticancer activity of
phenazinamine derivatives
Gajanan Sonwane
and
Mayura Kale
Government College of Pharmacy, India