Molecular docking analysis of phytochemicals from Soothaga Thadai Kudineer with cyp-17α-hydroxylase enzyme
Polycystic ovarian syndrome (PCOS) affects 9.2% of women of reproductive age and has doubled in prevalence, rising from 6 million cases in 1990 to 12.13 million in 2019. PCOS is characterized by symptoms like irregular periods, acne, hirsutism, male-pattern baldness, weight gain, mood swings and infertility. PCOS is primarily associated with elevated androgen levels. The use of Indian <i>Soothaga Thadai Kudineer</i> for managing PCOS is well documented. Therefore, it is of interest to report the <i>Molecular docking</i> analysis of phytochemicals from Indian <i>Soothaga Thadai Kudineer</i> with cyp-17α-hydroxylase enzyme (CYP17). Analysis shows that phytochemicals such as gingerenone A, chlorogenic acid and piperine present in <i>Soothaga Thadai Kudineer</i> exhibit strong binding affinities to the enzyme suggesting their potential as CYP17 inhibitors for further validation and consideration.
Authors
- Shunmugaram Shenbagaraj
- Vinu Bharathi Balasubramaniam (ORCID: https://orcid.org/0000-0003-2203-6760)
- Siva Annamalai
- S. Balasubramaniyan (ORCID: https://orcid.org/0000-0003-1066-9878)
- Deepa Ravichandran
- Vinodini Ramamoorthy
Institutions
- Tamil University (IN)
- Central Council for Research in Siddha (IN)
Publication Details
- Journal
- Bioinformation
- Published
- 2025-02-28
- DOI
- https://doi.org/10.6026/973206300210274
- Primary Topic
- Computational Drug Discovery Methods
- Type
- article
- Field-Weighted Citation Impact
- 0.00