Author(s): Silviana Hasanuddin, Dolih Gozali, Muhammad Arba, Dwi Syah Fitra Ramadhan, Resmi Mustarichie


DOI: 10.52711/0974-360X.2022.00202   

Address: Silviana Hasanuddin1,4*, Dolih Gozali2, Muhammad Arba3, Dwi Syah Fitra Ramadhan4, Resmi Mustarichie1
1Pharmaceutical Analysis and Medicinal Chemistry Department, Faculty of Pharmacy, Universitas Padjadjaran, Sumedang, Indonesia.
2Pharmaceutical Department, Faculty of Pharmacy, Universitas Padjadjaran, Sumedang, Indonesia.
3Faculty of Pharmacy, Universitas Halu Oleo, Kendari, Indonesia.
4Department of Pharmacy, Universitas Mandala Waluya, Kendari, Indonesia.
*Corresponding Author

Published In:   Volume - 15,      Issue - 3,     Year - 2022

Introduction: Alopecia is a hair loss that occur continuously and may occur in men, women and children. The causes of alopecia, including the use of cosmetics, medication, stress, postpartum period, hormonal disorders, and scalp infection. The purpose of this research is to determine the compounds contained in Petroselinum crispum that have the potential as antialopecia agents by predicting ligand-receptor binding and binding modes, predicting ADME by using Lipinski's rule, and also comparing the effectiveness with native ligand and minoxidil. Methodology: The process starts with protein and ligand structure preparation, then docking using Autodock Vina. Afterward, analyzed and visualized of the ligands docking, and predicted the ADME according to lipinski's rules using SwissADME and toxicity using PASS predistion. Result: There were 24 compounds found in Petroselinum crispum. Molecular docking simulation showed that six compounds had better binding affinities than minoxidil. Based on the results of prediction of ADMET values using the Lipinski rule and PASS Prediction, compound that are thought to have good activity is (+)–Marmesin compared to minoxidil. Conclusion: (+)–Marmesin to have better interactions with the androgen receptor, but not better than native ligands. thus, (+)–Marmesin can be used as antialopecia agents alternative terapy.

Cite this article:
Silviana Hasanuddin, Dolih Gozali, Muhammad Arba, Dwi Syah Fitra Ramadhan, Resmi Mustarichie. In Silico Prediction of Metabolite in Petroselinum Crispum in Inhibiting Androgen Receptor as Treatment for Alopecia. Research Journal of Pharmacy and Technology. 2022; 15(3):1211-8. doi: 10.52711/0974-360X.2022.00202

Silviana Hasanuddin, Dolih Gozali, Muhammad Arba, Dwi Syah Fitra Ramadhan, Resmi Mustarichie. In Silico Prediction of Metabolite in Petroselinum Crispum in Inhibiting Androgen Receptor as Treatment for Alopecia. Research Journal of Pharmacy and Technology. 2022; 15(3):1211-8. doi: 10.52711/0974-360X.2022.00202   Available on:

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