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Shabani, Alireza, Zaefizadeh, Mohammad, Farhadpour, Mohsen, Soheila s\Soheili, Zahra, Esfahani, Kasra. (1403). Phytochemical and Biomedical Analysis of β-cyclocitral Extracted from Galium mite (Medicinal Herb), and its Effects on Breast Cancer Targeted Proteins. سامانه مدیریت نشریات علمی, 14(3), 238-244. doi: 10.22034/jmpb.2024.366588.1732
Alireza Shabani; Mohammad Zaefizadeh; Mohsen Farhadpour; Zahra Soheila s\Soheili; Kasra Esfahani. "Phytochemical and Biomedical Analysis of β-cyclocitral Extracted from Galium mite (Medicinal Herb), and its Effects on Breast Cancer Targeted Proteins". سامانه مدیریت نشریات علمی, 14, 3, 1403, 238-244. doi: 10.22034/jmpb.2024.366588.1732
Shabani, Alireza, Zaefizadeh, Mohammad, Farhadpour, Mohsen, Soheila s\Soheili, Zahra, Esfahani, Kasra. (1403). 'Phytochemical and Biomedical Analysis of β-cyclocitral Extracted from Galium mite (Medicinal Herb), and its Effects on Breast Cancer Targeted Proteins', سامانه مدیریت نشریات علمی, 14(3), pp. 238-244. doi: 10.22034/jmpb.2024.366588.1732
Shabani, Alireza, Zaefizadeh, Mohammad, Farhadpour, Mohsen, Soheila s\Soheili, Zahra, Esfahani, Kasra. Phytochemical and Biomedical Analysis of β-cyclocitral Extracted from Galium mite (Medicinal Herb), and its Effects on Breast Cancer Targeted Proteins. سامانه مدیریت نشریات علمی, 1403; 14(3): 238-244. doi: 10.22034/jmpb.2024.366588.1732

Phytochemical and Biomedical Analysis of β-cyclocitral Extracted from Galium mite (Medicinal Herb), and its Effects on Breast Cancer Targeted Proteins

Journal of Medicinal plants and By-products
مقاله 4، دوره 14، شماره 3، مرداد و شهریور 2025، صفحه 238-244    اصل مقاله (1001.25 K)
نوع مقاله: Research Paper
شناسه دیجیتال (DOI): 10.22034/jmpb.2024.366588.1732
نویسندگان
Alireza Shabani1؛ Mohammad Zaefizadeh* 2؛ Mohsen Farhadpour1؛ Zahra Soheila s\Soheili3؛ Kasra Esfahani* 1
1Plant Bioproducts Department, National Institute of Genetic Engineering and Biotechnology (NIGEB), Tehran, Iran
2Biology Department, Ardabil Branch, Islamic Azad University, Ardabil, Iran
3Molecular Medicine Department, National Institute of Genetic Engineering and Biotechnology (NIGEB), Tehran, Iran
چکیده
Molecular docking PyRx software coupled with gas chromatography/mass spectrometry (GC-MS) was used to identify predicted proteins which were targeted by β-cyclocitral derived from Galium mite var. roseum Ghahr. Twenty-four phytochemical compounds were detected using the GC-MS technique. Physiochemical qualities of β-cyclocitral were done using Pubchem database. Pharmaceutical and pharmacokinetic properties of the extracted β-cyclocitral were evaluated using SwissADME and GeneCards databases. One hundred entries were determined in this query. Molecular docking properties were implemented using PyRx software. Results indicated that twenty-two of these entries were predicted to be candidate as target proteins in breast cancer treatment. Catepsin k, Andregone receptor, Alcohol dehydrogenase alpha chain, Cytochrome P450 17A1 and Prostaglandin E synthase with binding affinity of 6.5, 6.2, 6, 5.7, and 5.7kcal/mol, exhibited the highest binding affinity with target proteins respectively. The project results revealed that β-cyclocitral could be used as a ligand in targeting proteins evolved in breast cancer.
کلیدواژه‌ها
Breast cancer؛ Galium mite؛ B-cyclocitral؛ Molecular docking
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