Title
Molecular docking analysis of glycogen phosphorylase with inhibitors from Cissampelos pareira Linn.
Authors
Kirubhanand Chandrashekar1, Ponnulakshmi Rajagopal2, Shazia Fathima JH3, Saravanan Radhakrishnan4, Vijaya Prakash Krishnan Muthaiah5, Bharat Ramrao Sontakke6, Vishwajit Ravindra Deshmukh7, Vijayalakshmi Periyasamy8, Gayatri Girish Muthiyan9, Aaditya Madhusudan Tarnekar10, T S Gugapriya11, Patil Ashlesh Laxman12, Satyendra Chandra Tripathi13 & Selvaraj Jayaraman14,*
Affiliation
1Department of Anatomy, AIIMS, Nagpur 441108, India; 2Central Research Laboratory, Meenakshi Academy of Higher Education and Research (Deemed to be University), Chennai-600 078, India; 3Department of Oral and Maxillofacial Pathology, Ragas Dental College and Hospitals, Chennai, India; 4Department of Biochemistry, Karapaga Vinayaga Institute of Medical and Dental science, Madhuranthagam- 603308, Tamil Nadu, India; 5Department of Rehabilitation Science, School of Public Health and Health professions, 633 Kimball, Buffalo NY, 14214-3079; 6Department of Anatomy, AIIMS, Nagpur 441108, India; 7Department of Anatomy, AIIMS, Nagpur 441108, India; 8DBT-BIF Centre, PG & Research Department of Biotechnology & Bioinformatics, Holy Cross College (Autonomous), Trichy, Tamilnadu, India; 9Department of Anatomy, AIIMS, Nagpur 441108, India; 10Department of Anatomy, AIIMS, Nagpur 441108, India; 11Department of Anatomy, AIIMS, Nagpur 441108, India; 12Department of Physiology, AIIMS, Nagpur 441108, India; 13Department of Biochemistry, AIIMS, Nagpur 441108, India; 14Department of Biochemistry, Saveetha Dental College and Hospitals, Saveetha Institute of Medical and Technical Sciences, Saveetha University, Chennai - 600 077, India; Corresponding author*
Kirubhanand Chandrashekar - kirubhanand@aiimsnagpur.edu.in Ponnulakshmi Rajagopal - ramgslaks@gmail.com Shazia Fathima JH - shaziafathimarizwan@gmail.com Saravanan Radhakrishnan - saravanabio@gmail.com Vijaya Prakash Krishnan Muthaiah - vijayapr@buffalo.edu Bharat Ramrao Sontakke - sontakkebr@aiimsnagpur.edu.in Vishwajit Ravindra Deshmukh - vishwajitdeshmukh@aiimsnagpur.edu.in Vijayalakshmi Periyasamy - pvijibi@gmail.com Gayatri Girish Muthiyan - gayatrimuthiyan@aiimsnagpur.edu.in Aaditya Madhusudan Tarnekar - tarnekaram@aiimsnagpur.edu.in TS Gugapriya - gugapriyats@aiimsnagpur.edu.in Patil Ashlesh Laxman - dr.ashlesh.p@aiimsnagpur.edu.in Satyendra Chandra Tripathi - sctripathi@aiimsnagpur.edu.in Selvaraj Jayaraman - jselvaendo@gmail.com
Article Type
Research Article
Date
Received August 10, 2021; Revised October 15, 2021; Accepted October 15, 2021, Published October 31, 2021
Abstract
Cissampelos pareira Linn. is a climbing herb known in Indian traditional medicine as laghupatha. It belongs to the Menispermaceae family. The enzyme glycogen phosphorylase (GP) is a promising target for the treatment of type-2 diabetes (T2DM). A variety of natural product inhibitors with both pharmaceutical and nutraceutical potential have been reported in the search for powerful, selective and drug-like GP inhibitors that could lead to hypoglycemic medicines. Therefore, it is of interest to document the molecular docking analysis data of glycogen phosphorylase with compounds from Cissampelos pareira Linn. We report the optimal binding features of 4 compounds namely Trans-N-feruloyltyramine, Coclaurine, Magnoflorine, and Curine with the target protein for further consideration in the context of T2DM.
Keywords
Diabetes mellitus, Cissampelos pareira, Glycogen phosphorylase, Molecular docking
Citation
Chandrashekar et al. Bioinformation 17(10): 866-869 (2021)
Edited by
P Kangueane
ISSN
0973-2063
Publisher
License
This is an Open Access article which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly credited. This is distributed under the terms of the Creative Commons Attribution License.
