Article Per Year (5 Year)
p-Index From 2019 - 2024
5.29
P-Index
This Author published in this journals
All Journal Pharmaciana: Jurnal Kefarmasian Biogenesis: Jurnal Ilmiah Biologi Jurnal Riset Kimia Indonesian Journal of Pharmaceutical Science and Technology Jurnal Biodjati ALCHEMY Jurnal Penelitian Kimia JSFK (Jurnal Sains Farmasi & Klinis) JURNAL ILMU KEFARMASIAN INDONESIA JURNAL FARMASI GALENIKA Majalah Farmasetika Jurnal Ilmiah Farmasi Farmasyifa Abdi Dosen : Jurnal Pengabdian Pada Masyarakat Pharmaceutical Sciences and Research (PSR) Bandung Conference Series: Pharmacy Borneo Journal of Pharmacy
Fitrianti Darusman
Farmasi, Fakultas Matematika Dan Ilmu Pengetahuan Alam, Universitas Islam Bandung
Religion Agriculture, Biological Sciences & Forestry Humanities Biochemistry, Genetics & Molecular Biology Chemical Engineering, Chemistry & Bioengineering Chemistry Computer Science & IT Earth & Planetary Sciences Education Energy Environmental Science Health Professions Immunology & microbiology Materials Science & Nanotechnology Medicine & Pharmacology Public Health Social Sciences

Published : 48 Documents Claim Missing Document
Claim Missing Document
Check
Articles

Found 1 Documents
Search
Journal : Biogenesis: Jurnal Ilmiah Biologi

 1 
Biological activity, molecular docking, and ADME predictions of amphibine analogues of Ziziphus spina-christi towards SARS-CoV-2 Mpro Taufik Muhammad Fakih; Dwi Syah Fitra Ramadhan; Fitrianti Darusman
Biogenesis: Jurnal Ilmiah Biologi Vol 9 No 1 (2021)
Publisher : Department of Biology, Faculty of Sci and Tech, Universitas Islam Negeri Alauddin Makassar

Show Abstract | Download Original | Original Source | Check in Google Scholar | DOI: 10.24252/bio.v9i1.21335

Abstract

The main protease of the SARS-CoV-2 virus, SARS-CoV-2 Mpro, can be discovered as a promising target to treat the COVID-19 pandemic. The peptide-based inhibitors may present better options than small molecules to inhibit SARS-CoV-2 Mpro. Ziziphus spina-christi species reported have a peptide-based of alkaloids group, i.e., amphibine whose analogues can be identified the potential as an inhibitor of SARS-CoV-2 Mpro. The compound structure was drawn and optimized using semi-empirical AM-1 method using Quantum ESPRESSO v.6.6, while the biological activity using PASS. Prediction server and molecular docking simulation using MGLTools 1.5.6 with AutoDock 4.2 were performed. Afterward, the ADME profiles were predicted using the SWISS-ADME server. PASS server was predicting amphibine B-F and H showed potency both as antiviral and as a protease inhibitor. The molecular docking simulation of amphibine analogues showed lower binding energy than the native ligand. The binding energy of the native ligand was −7.69 Kcal/mol compared to the lowest binding energy of amphibine analogues was −10.10 Kcal/mol (amphibine-F). The ADME prediction showed that amphibine-F has the best bioavailability as an oral drug, amphibine-B, C, and D have good bioavailability, and amphibian-E and H have poor bioavailability. Concluded, amphibine B-F and H of amphibine analogues showed potency as COVID-19 treatment targeting SARS-CoV-2 Mpro.
Co-Authors Amila Amila Amila Amila, Amila Anan Suparman Anan Suparman Annisa Meilani Aprian Dwiatama Aprian Dwiatama Aulia Fikri Hidayat Aulia Fikri Hidayat Azyyati Adzhani Budi Prabowo Soewondo Cepy Hadiansyah Cepy Hadiansyah, Cepy Dea Legina Ayu Kusumah Debby Prihasti Ayustine Dewi, Mentari Luthfika Dinnanda Yussepina Wulansari Dinnanda Yussepina Wulansari Dwi Syah Fitra Ramadhan Endah Rahayu Endah Rahayu, Endah Fia Siti Nopalia Firda Aulia Jannati Frida Anggita Amalia Gina Fuji Nurfarida Gita Cahya Eka Darma Hanifa Rahma Hery Hamdi Azwir Hilda Aprilia, Hilda Hirawati Oemar Inayah Fitri Wulandari Inayah Fitri Wulandari Indra Topik Indra Topik, Indra Jihan Sahira Khairani, Astrid Feinisa Larasati Sofiyandini Marillia, Viola Mega Suryani Putri Mentari Lutfika Dewi Mentari Luthfika Dewi Muhamad Rizqy Maulana Muhammad Sultan Ramadhan Mutiara Haifania Nawang Wulan Rachmatillah Prastowo Putri Niken Fitria Yuliar Nurrayyan Nurrayyan Nurrayyan, Nurrayyan Nyayu Ista Yulita Putri, Nawang Wulan Rachmatillah Prastowo Rachmat Mauludin Rachmat Mauludin Ratih Aryani Ratih Aryani Riza Ramadhan Rodliyah Khuza’i Saadiya Noerman Sani Ega Priani Soewandhi, Sundani N Sundani N Soewandhi Syafanisa Alifia Rahma Syifa Siti Fatimah Azzahro Syilfiana Anwar Taufik Muhammad Fakih Teti Sofia Yanti Tia Aulia Silvianti Uci Ary Lantika Uci Ary Lantika Ulfa Siti M Viola Marillia Widad Aghnia Shalannandia Widad Aghnia Shalannandia Yan Orgianus Yukeu Fazriah Yukeu Fazriah, Yukeu Zalfa Ainun Rozak