STUDI PENAMBATAN MOLEKULER DAN PREDIKSI PROFIL FARMAKOKINETIK KANDUNGAN KIMIA SELASIH (Ocimum basilicum L.) TERHADAP TARGET TERAPI TUBERKULOSIS

Budiyana, Agatha Ria (2021) STUDI PENAMBATAN MOLEKULER DAN PREDIKSI PROFIL FARMAKOKINETIK KANDUNGAN KIMIA SELASIH (Ocimum basilicum L.) TERHADAP TARGET TERAPI TUBERKULOSIS. Skripsi thesis, Universitas Setia Budi.

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Abstract

Tuberculosis is an infectious disease caused by M. tuberculosis is acid resistant. Therapeutic target proteins from tuberculosis were identified as P38 MAPK, ERK2, JNK, Pantothenate Kinase (PanK), and Protein kinase G (PknG). The use of herbs is an alternative for treatment such as the compound content of basil. This study aims to determine the potential of basil compounds to bind to therapeutic target proteins of tuberculosis and to evaluate the pharmacokinetic parameters of selected compounds. This study was used a molecular docking method with Autodock 4 software and eleven compounds of selasih (Ocimum basilicum L.) as test ligands. Results was selected taking into account the lowest binding energy and num in clus. The selected compounds was continued by observing the ligand-protein interaction using the Discovery Studio Visualizer and then the compound was carried out by pharmacokinetic predictions using ADMETLab. The results of the molecular docking process found that six compounds from basil had the best interactions with antituberculosis therapeutic proteins, namely compounds bacilicin, acetyl bacilicin, 4'-carbomethoxy-2'-hydroxyphenyl ferulate, luteolin, orientin, and rosmarinic acid. The pharmacokinetic prediction results of the selected compounds found mixed results but the best compound chosen was bacilicin and acetyl bacilicin. This prediction needs to be tested directly to see its true potential. Keywords : tuberculosis, selasih, molecular docking

Item Type:	Thesis (Skripsi)
Uncontrolled Keywords:	tuberculosis, selasih, molecular docking
Subjects:	R Medicine > RS Pharmacy and materia medica
Divisions:	Fakultas Farmasi > Prodi S1 Farmasi
Depositing User:	Tifany Nur Arfiana
Date Deposited:	21 Jul 2022 03:57
Last Modified:	21 Jul 2022 03:57
URI:	http://repo.setiabudi.ac.id/id/eprint/4925

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