Synthesis, Antiproliferative Activity and Molecular Docking Studies of Novel 1,3,5-Triaryl Pyrazole Compound as Estrogen α Receptor Inhibitor Targeting MCF7 Cell Line
| Autor: | Noval Herfindo, Riska Prasetiawati, Daniel Sialagan, Neni Frimayanti, Adel Zamri |
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| Jazyk: | English<br />Indonesian |
| Rok vydání: | 2020 |
| Předmět: | |
| Zdroj: | Molekul, Vol 15, Iss 1, Pp 18-25 (2020) |
| Druh dokumentu: | article |
| ISSN: | 1907-9761 2503-0310 |
| DOI: | 10.20884/1.jm.2020.15.1.585 |
| Popis: | This research have been successfully synthesize novel compound of 1,3,5-triaryl pyrazole derivatives. Firstly, 3-(3-bromophenyl)-5-(2-methoxyphenyl)-1-phenyl-4,5-dihydro-1H-pyrazole (4) compound was obtained by multicomponent reaction of ketone, aldehyde and hydrazine in basic condition. Then, 3-(3-bromophenyl)-5-(2-methoxyphenyl)-1-phenyl-1H-pyrazole (5) compound was obtained by oxidative aromatization of compound 4 in the presense of iodine in acetic acid. Structure of predicted molecules were confirmed by FTIR, NMR and HRMS spectroscopy data analysis. Antiproliferative activity of compound 5 was evaluated by in vitro assay against MCF-7 cells and molecular docking simulation against ERα (PDB ID: 3ERT) using MOE 2019. Biological evaluation result showed that compound 5 has weak antiproliferative activity with IC50 was 8mM whereas the docking studies agrees the result. |
| Databáze: | Directory of Open Access Journals |
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