Molecular docking analysis of aspirin analogues with β-catenin

Jayaraman Selvaraj; Hussain Sardar; Veeraraghavan Vishnupriya; Janardhana Papayya Balakrishna; Surapaneni Krishna Mohan; Rajamanickam Pon Nivedha; Periyasamy Vijayalakshmi; Rajagopal Ponnulakshmi

doi:10.6026/97320630016725

Molecular docking analysis of aspirin analogues with β-catenin

Bioinformation. 2020 Sep 30;16(9):725-730. doi: 10.6026/97320630016725. eCollection 2020.

Authors

Jayaraman Selvaraj¹, Hussain Sardar², Veeraraghavan Vishnupriya¹, Janardhana Papayya Balakrishna³, Surapaneni Krishna Mohan⁴, Rajamanickam Pon Nivedha⁵, Periyasamy Vijayalakshmi⁶, Rajagopal Ponnulakshmi⁷

Affiliations

¹ Department of Biochemistry, Saveetha Dental College and Hospitals, Saveetha Institute of Medical and Technical Sciences, Saveetha University, Chennai - 600 077, India.
² Department of Biotechnology, Government Science College, Chitradurga-577501, Karnataka, India.
³ Department of Stem Cell Biology, Stellixir Biotech Pvt Ltd, No.V-31, 2nd floor, 10th Main Road, Peenya 2nd Stage Industrial Area, Bangalore - 560058, Karnataka, India.
⁴ Department of Biochemistry and Department of Clinical Skills & Simulation, Panimalar Medical College Hospital & Research Institute, Varadharajapuram, Poonamallee, Chennai - 600 123, India.
⁵ Exonn Biosciences, Ticel Bio Park, Chennai-600 0113, India.
⁶ PG & Research Department of Biotechnology & Bioinformatics, Holy Cross College (Autonomous), Trichy- 620002, Tamil Nadu, India.
⁷ Central Research Laboratory, Meenakshi Academy of Higher Education and Research (Deemed to be University), Chennai-600 078, India.

Abstract

Canonical Wnt signaling pathway plays a crucial role in cancer cell proliferation, which links by the growth of β-catenin in cell due to inactivation of glycogen synthetase kinase-3. Therefore, it is of interest to design novel candidates to bind with β-catenin. Hence, we document the molecular docking analysis data of aspirin analogues with β-catenin for further consideration.

Keywords: ADME; Colon cancer; Wnt signaling; molecular docking.