MOLEKULAR DOCKING DAN PREDIKSI PROFIL FARMAKOKINETIK KANDUNGAN KIMIA Cucurbita moschata, Momordica charantia, DAN Luffa acutangula SEBAGAI ANTIDIABETES

Ilmiawan, Fahmi (2019) MOLEKULAR DOCKING DAN PREDIKSI PROFIL FARMAKOKINETIK KANDUNGAN KIMIA Cucurbita moschata, Momordica charantia, DAN Luffa acutangula SEBAGAI ANTIDIABETES. Skripsi thesis, Universitas Setia Budi.

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Abstract

Luffa acutangula, Cucurbita moschata, and Momordica charantia herbs extract from Cucurbitaceae have been reported to have antidiabetic activity from various studies. This study aimed to predict antidiabetic properties of phytochemical constituents of Luffa acutangula, Cucurbita moschata, and Momordica charantia as well as to study their interaction to various macromolecular targets of antidiabetic agent Dipeptidyl-Peptidase 4 enzyme (DPP4), Protein tyrosine phospahatase-1B (PTP1B), Glucokinase, Alpha glucosides using molecular docking. AutoDock Vina in PyRx was used and the results were presented as binding affinity values (kcal/mol). Program PyMOL was used to visualize the 3D molecular of docked conformation and ligand-protein interactions. Also we were study the pharmacokinetic profil of extract by SwissADME of its chemical compound. The result showed that DPP4 had the best binding score on Acutoside D (Luffa acutangula), Momordicosides D (Momordica charantia), and Auroxanthin (Cucurbita moschata). Glucokinase showed the best binding score on Alpha carotene (Cucurbita moschata), Carotene (Luffa acutangula) and Omargliptine (Momordica charantia). PTP1B gave the best binding score on Acutoside G (Luffa acutangula), Auroxanthin (Cucurbita moschata) and Kuguacin B (Momordica charantia). Alpha glucosides showed the best antidiabetic binding score on Acutoside B (Luffa acutangula), Kuguacin B (Momordica charantia) and Auroxanthin (Cucurbita moschata). But only Kuguacin B that has a good interaction patern and pharmacokinetic profil. Keywoard: Cucurbitaceae, Antidiabetic, Macromolecular target, Molecular Docking, Pharmacokinetic profil

Item Type:	Thesis (Skripsi)
Uncontrolled Keywords:	Cucurbitaceae, Antidiabetic, Macromolecular target, Molecular Docking, Pharmacokinetic profil
Subjects:	R Medicine > R Medicine (General)
Depositing User:	Tifany Nur Arfiana
Date Deposited:	20 Jan 2020 04:33
Last Modified:	20 Jan 2020 04:33
URI:	http://repo.setiabudi.ac.id/id/eprint/4046

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