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All Journal Biota: Jurnal Ilmiah Ilmu-Ilmu Hayati Indonesian Journal of Cancer Chemoprevention Indonesian Journal of Pharmaceutical Science and Technology Indonesian Journal of Biotechnology Dental Journal (Majalah Kedokteran Gigi) The Indonesian Biomedical Journal Indonesian Journal of Pure and Applied Chemistry Pharmacoscript Jurnal Insan Farmasi Indonesia Indonesian Journal of Biological Pharmacy Medical Sains : Jurnal Ilmiah Kefarmasian Journal of Pharmaceuticals and Natural Sciences Medical Sains : Jurnal Ilmiah Kefarmasian Indonesian Journal of Chemical Science Jurnal Sains dan Teknologi Jurnal Farmasi Sains dan Terapan (Journal of Pharmacy Science and Practice)
Dhania Novitasari
Cancer Chemoprevention Research Center (CCRC), Faculty Of Pharmacy, Universitas Gadjah Mada, Sekip Utara, Yogyakarta 55281, Indonesia
Agriculture, Biological Sciences & Forestry Biochemistry, Genetics & Molecular Biology Chemistry Civil Engineering, Building, Construction & Architecture Computer Science & IT Dentistry Health Professions Immunology & microbiology Materials Science & Nanotechnology Medicine & Pharmacology Physics Public Health Transportation

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Bioactive Compounds from Kaempferia angustifolia Roxb. as Potential AKT1-Targeted Anticancer Agents: In Silico Studies Saputra, Maitry; Budhiman, Muhammad Darrel Ghariza; Nedy, Meunasha Syadza; Pratama, Muhammad Hafizh Putra; Aziz, Syarif Rahmat; Anjani, Fasya Assyla; Novitasari, Dhania
Indonesian Journal of Biological Pharmacy Vol 6, No 2 (2026): IJBP
Publisher : Department of Biological Pharmacy, Faculty of Pharmacy, Universitas Padjadjaran

Show Abstract | Download Original | Original Source | Check in Google Scholar | DOI: 10.24198/ijbp.v6i2.71568

Abstract

Cancer is characterized by uncontrolled cell growth and proliferation, often progressing to invasion and metastasis. Among the signaling cascades driving this process, the PI3K/AKT/mTOR pathway plays a central role in regulating cell survival, proliferation, and apoptosis, with the AKT1 isoform frequently implicated in oncogenic transformation through gain-of-function mutations and aberrant activation. This study evaluated the anticancer potential of bioactive compounds from Kaempferia angustifolia Rosc. (kunci pepet) as AKT1 inhibitor candidates through an integrated in silico approach, encompassing Lipinski's Rule of Five, ADMETox prediction, pharmacophore screening, and molecular docking against the AKT1 receptor. Thirty structurally diverse compounds, representing multiple secondary metabolite classes, were selected to examine how structural variation influences AKT1 binding; twenty-nine were successfully evaluated through molecular docking. Nine compounds, including flavokawain A, alpinetin, zeylenol, α-cyperone, crotepoxide, kaempferol, sandaracopimaradiene, β-sitosterol, and eleutherin, emerged as promising candidates based on favorable drug-likeness, safety profiles, and binding characteristics. Among these, zeylenol achieved the highest pharmacophore fit score (40.11) and a binding energy (−8.37 kcal/mol) surpassing the native ligand, while kaempferol showed comparable docking performance. These findings position zeylenol as the most promising AKT1 inhibitor candidate from K. angustifolia, warranting further experimental validation for anticancer drug development.
Co-Authors Adam Hermawan Ade Safitri Agung Adnan Pratama Agus Rusdin Agus Rusdin Agus, Rusdin Aisyah Nur Aisyah Tasza Noor Alifa, Zahra Aliya, Najma Alya Izzati Zhafira, Rizal Andhryanti, Rifa Nurfadila Andi Salwa Karima Andika Andika Anindya Nursanti Syaiful Anjani, Fasya Assyla Anselma Ivanawati Aprilliana Kurnia Ulla Ardhita Marshella Dhanu Ari Anggi Mahwati Ashriany, Raissa Rerey Aziz, Syarif Rahmat Azzahra, Iqlima Banun Kusumawardani Beni Lestari Bintang Satrio Mahardika Bintang Satrio Mahardika Budhiman, Muhammad Darrel Ghariza Cahyaningrum, Lydia Cantik Batrisyia Ali CINDY CINDY Devyanto Hadi Triutomo Dinar Umaimah Radani Dwi Merry Christmarini Robin Ediati Sasmito Ediati Sasmito Edy Meiyanto Edy Meiyanto Edy Meiyanto Edy Meiyanto Edy Meiyanto Faaza Aulia Rahman Fachrizal Dwi Kautsar Fadhilah, Naya Fahrana Rosani Fahri Renaldi Fardhan, Firghi Muhammad Fathin Nayla Maymuna Fathin Nayla Maymuna Fathin, Nayla Maymuna Fa’aizah Masayu Kyla Fiona Puspita, Sari Fitriana Hayyu Arifah Gabriel, Kevin Herwandhani Putri Hess, Aurelina Yunita Ida Musfiroh -, Ida Musfiroh Ignasia Anindya Pintagratia Irene Ivory Sibuea Ismail, Dzava Prawinsyah Fairus Jasimah Jasimah Jun-ya Kato Justin, Felix Kato, Jun-Ya Kevin Gabriel Laeli Muntafiah Lathifah, Salma Sri Layung Sekar Sih Wikanthi Lestari, Mila Ayu Lintang Gusti Kinanti Maharani, Anisa Mahardika, Bintang Satrio Mahira, Tsania Marshella Dhanu, Ardhita Martiza Aulia Masayu Kyla, Fa’aizah Masyithah Sitti MEGANTARA, SANDRA Meilia Suherman Moordiani Moordiani Moulana, Mohammad Zaeni Muchtaridi Muchtaridi Muhammad Syahid Muljono, Fajar Oktavian Muthi Ikawati Nabilah, Rahmadhani Najla Yasmintia Widarso Nawadhir Fauzan Nayla Maymuna, Fathin Nedy, Meunasha Syadza Nindi Wulandari Nunuk Purwanti Nur Fitra Sari Nurhaliza, Muthiah Oktaviana, Lina Pramudita, Fransisca Widi Pratama, Muhammad Hafizh Putra Prisnu Tirtanirmala Putri Salma Chiara Putri, Anindya Calista Nabila Putri, Nazwa Septiriana Qurrotaayun, Ghina Alya Putri Raden Verlisa Febriani Rahmadhani Nabilah Rahmaharva, Naila Dwi Rahmawati Rahmawati Ramadhani, Siti Zhahira Ratna Asmah Susidarti Retno Ardhani Retno Murwanti Riefka Berliana Khoir Riris Istighfari Jenie Riris Istighfari Jenie Riska Prasetiawati Rizal Alya Izzati Zhafira Rubianti, Retno Rusdin Agus Rusdin, Agus Rusmina Aulia Hasanah Sabiila, Annisa Ahda Salma Chiara, Putri Salsabila, Sitti Kesya Salsabilla Rifa Alya Salsabilla, Bunga Indra Saputra, Maitry Sari Fiona Puspita Sari Haryanti Shafa, Nafis Sitompul, Joy Elizabeth Nauli Sitti, Masyithah Sri Handayani Tarisa Nurafni Romadhona Tasza Noor, Aisyah Viona Algesia Fiola Putri Wahyuni Sri Yolla Adellia Putri Zahrotul Ulum Zhafirah, Noor