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All Journal snimed Indonesian Journal of Pharmaceutical Science and Technology Jurnal Ilmu Farmasi dan Farmasi Klinik (Journal of Pharmaceutical Science and Clinical Pharmacy) Majalah Obat Tradisional INDONESIAN JOURNAL OF PHARMACY Jurnal Farmasi Sains dan Komunitas Indonesian Journal of Chemistry Indonesian Journal of Pharmacology and Therapy
Maywan Hariono
Faculty Of Pharmacy, Sanata Dharma University
Chemical Engineering, Chemistry & Bioengineering Chemistry Computer Science & IT Health Professions Immunology & microbiology Medicine & Pharmacology Public Health

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Molecular docking study of Indonesian phytochemicals as inhibitor of 6-HB formation by binding to HR1 subunit of SARSCOV-2 S2 protein Julianus, Jeffry; Phebe Hendra; Maywan Hariono; Nico Frederick; Satrio Ardyantoro; Mustofa; Jumina
Indonesian Journal of Pharmacology and Therapy Vol 2 No 3 (2021): Special Issue: COVID-19
Publisher : Faculty of Medicine, Public Health, and Nursing Universitas Gadjah Mada and Indonesian Pharmacologist Association or Ikatan Farmakologi Indonesia (IKAFARI)

Show Abstract | Download Original | Original Source | Check in Google Scholar | DOI: 10.22146/ijpther.2392

Abstract

Coronavirus disease 2019 (COVID-19) is still as global pandemic. No officially drugs to treat COVID-19 are available until now. Increasing number of patients and deaths trigger new antiCOVID-19 discovery efforts. In this study, we have conducted in silico screening employing molecular docking for Indonesian phytochemicals. Docking process was performed by employing AutoDock4 software on crystal structure 6VSB. Based on molecular docking results, several compounds had potential as antiCOVID-19 drugs, such as β-carotene, veramiline, ecliptalbine, betulinic acid, and lupeol. β-carotene was the most potential compound to treat COVID-19.
Co-Authors Agus Suprijono Benedictus Wisnu Putra Jati Dewi Setyaningsih Dina Christin Ayuning Putri Dwi Hadi Setya Palupi Enade Perdana Istyastono Enade Perdana Istyastono Ervan Setyo Nugroho Florentinus Dika Octa Riswanto Hanievia Rahayunnissa Hanny Setyowati Jasson Rhinehard Karamoy Jeffry Julianus Jumina Jumina Jumina Kevin Cahaya Putra Mustofa Mustofa Mustofa Nico Frederick Nico Frederick Pandu Hariyono Phebe Hendra Phebe Hendra Reynaldo Tiara Rini Dwiastuti risha fillah fithria Rollando, Rollando Roy Gunawan Wicaksono Sangga Putra Dewa Satrio Ardyantoro Satrio Ardyantoro Sri Hartati Yuliani Wahyuning Setyani Yohanes Krisna Wisnumurti