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.

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Bioinformation
Published
2025-02-28
DOI
https://doi.org/10.6026/973206300210274
Primary Topic
Computational Drug Discovery Methods
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article
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article

Molecular docking analysis of phytochemicals from Soothaga Thadai Kudineer with cyp-17α-hydroxylase enzyme

Shunmugaram Shenbagaraj, Vinu Bharathi Balasubramaniam, Siva Annamalai, S. Balasubramaniyan et al.
Bioinformation
Computational Drug Discovery Methods
article

Molecular docking analysis of phytochemicals from Soothaga Thadai Kudineer with cyp-17α-hydroxylase enzyme

Shunmugaram Shenbagaraj, Vinu Bharathi Balasubramaniam, Siva Annamalai, S. Balasubramaniyan, Deepa Ravichandran, Vinodini Ramamoorthy
article en

Abstract

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.

BioinformationVol. 21(2)
Tamil University (IN), Central Council for Research in Siddha (IN)
Openalex Percentile: Top 94%
Computational Drug Discovery Methods
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