Antipyretic Drug Candidates Through Reverse Docking Techniques Used In Science Learning

Authors

Muhamad Iksan , Frida M Yusuf , Fitriani B , Wa Ode Al Zarliani

DOI:

10.29303/jppipa.v9i8.4863

Published:

2023-08-25

Issue:

Vol. 9 No. 8 (2023): August

Keywords:

Antipyretic, Gingero, Red ginger, Reverse docking technique Shogaol

Research Articles

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Iksan, M., Yusuf, F. M. ., Fitriani B, F., & Al Zarliani, W. O. . (2023). Antipyretic Drug Candidates Through Reverse Docking Techniques Used In Science Learning. Jurnal Penelitian Pendidikan IPA, 9(8), 6398–6405. https://doi.org/10.29303/jppipa.v9i8.4863
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Abstract

Red ginger (Zingiber officinale var. Rubrum) is a commonly used rhizome known for its fragrant and spicy taste. It contains gingerol and shogaol compounds that have antipyretic effects by inhibiting prostaglandin formation and stimulating the production of interleukin-10, an endogenous antipyretic. This study aimed to evaluate the potential of gingerol and shogaol compounds as antipyretic drug candidates through reverse docking techniques targeting interleukin-10 (IL-10). Ten natural compounds from red ginger were predicted for their potential as antipyretic drugs and docked with the IL-10 receptor protein using various computer programs. The molecular docking results showed that (6)-shogaol had four amino acid bond residues that were the same as the ibuprofen control compound, indicating its potential as an antipyretic drug candidate. Furthermore, (6)-shogaol had the same binding affinity as the control compound and was safe for oral consumption based on pharmacokinetic and toxicity tests using Lipinski's Rule, Toxtree, and admet-T. These findings suggest that (6)-shogaol is a promising antipyretic drug candidate compared to other compounds. In conclusion, this study identified the potential of (6)-shogaol as an antipyretic drug candidate through reverse docking techniques targeting interleukin-10. Red ginger could provide a natural alternative for antipyretic drugs, and further research is recommended to explore the role of gingerol and shogaol compounds in targeting other proteins

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Author Biographies

Muhamad Iksan, Universitas Muhammadiyah Buton

Frida M Yusuf, Universitas Negeri Gorontalo

Fitriani B, Universitas Muhammadiyah Buton

Wa Ode Al Zarliani, Universitas Muhammadiyah Buton

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Copyright (c) 2023 Muhamad Iksan, Frida M Yusuf, Fitriani B, Wa Ode Al Zarliani

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