DOCKING ANTIOXIDANT ACTIVITY ON HYDROXY (DIPHENYL) ACETICACID AND ITS DERIVATIVES


Sudha Rajendran, Nithya G, Brindha Devi P, Charles C Kanakam

Abstract


Objectives: The antioxidant activity of the synthesized compounds along with the standard compound for comparison is reported. There is comparison of binding analysis and the ligand interaction of the compound.

Methods: The protein crystal structure complexed with 4-methyl-6-[2-(5-morpholin-4-ylpyridin-3-yl)ethyl]pyridin-2-amine inhibitor was selected from Protein Data Bank (5FVP) for our study.

Results: The docking studies and structure-activity relationship reveals that the compound 2’-chloro-4-methoxy-3nitro benzilic acid after three different docking strategies reveals that the score was found to be higher compared with others.

Conclusion: Based on the in vitro antioxidant results, the compounds synthesized were investigated for the molecular docking study to identify the amino acid interactions in the active site pocket of nitric oxide synthase enzyme. Based on the docking score results, all the compounds were oriented toward the active site pocket occupied by the cocrystallized ligand


Keywords


Docking, Antioxidant activity, Stacking interaction.

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About this article

Title

DOCKING ANTIOXIDANT ACTIVITY ON HYDROXY (DIPHENYL) ACETICACID AND ITS DERIVATIVES

Keywords

Docking, Antioxidant activity, Stacking interaction.

DOI

10.22159/ajpcr.2017.v10i7.18299

Date

01-07-2017

Additional Links

Manuscript Submission

Journal

Asian Journal of Pharmaceutical and Clinical Research
Vol 10 Issue 7 July 2017 Page: 263-265

Print ISSN

0974-2441

Online ISSN

2455-3891

Statistics

99 Views | 146 Downloads

Authors & Affiliations

Sudha Rajendran
Department of Chemistry, School of Basic Sciences, Vels University, Chennai, Tamil Nadu, India.
India

Nithya G
Department of Chemistry, School of Basic Sciences, Vels University, Chennai, Tamil Nadu, India.
India

Brindha Devi P
Department of Bio-engineering, School of Engineering, Vels University, Chennai, Tamil Nadu, India,
India

Charles C Kanakam
Depatment of Chemistry, Formerly Presidency College, University of Madras, Tamil Nadu, India.
India


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