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Suhas Sreehari,
- Student, Department of Biotechnology, B.M.S. College of Engineering, Bengaluru, Karnataka, India
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The aim of this research was to study the effects of the plant Anantmul (Hemidesmus Indicus) in treatment of Tay Sachs Disease using molecular docking studies. Tay Sachs disease is a neurodegenerative autosomal recessive disorder caused due to accumulation of the molecule GM2 ganglioside which is caused due to lack of enzyme Beta Hexosaminidase which breaks down GM2 Ganglioside. Anantmul (Hemidesmus indicus) is a an ayurvedic plant used in the Indian subcontinent which has many medicinal uses such as anti-cancer, anti-diabetic, anti-inflammatory etc. using IMPATT software about 110 phytochemicals were discovered in Anantmul, then using SWISS ADME about 45 compounds were screened based on the Lipinski’s rule. Then they were further screened based on toxicity using protox software down to 11 compounds. These 11 compounds were selected for molecular docking analysis on the protein Hexosaminidase to study their interaction and binding energy. Out of these the top 6 compounds with the highest binding energy was taken for visualization. The compound with the highest binding energy was found to be Abieta 7 13 dien 18 oic acid with a binding energy of -7.4.
Keywords: Multi target molecular docking of Anantmul (Hemidesmus Indicus) compounds for Tay Sachs disease Treatment
[This article belongs to International Journal of Bioinformatics and Computational Biology (ijbcb)]
Suhas Sreehari. Multi target molecular docking of Anantmul (Hemidesmus Indicus) compounds for Tay Sachs disease Treatment. International Journal of Bioinformatics and Computational Biology. 2024; 02(02):-.
Suhas Sreehari. Multi target molecular docking of Anantmul (Hemidesmus Indicus) compounds for Tay Sachs disease Treatment. International Journal of Bioinformatics and Computational Biology. 2024; 02(02):-. Available from: https://journals.stmjournals.com/ijbcb/article=2024/view=0
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| Volume | 02 |
| Issue | 02 |
| Received | 21/11/2024 |
| Accepted | 02/12/2024 |
| Published | 28/12/2024 |