Title of article
Diagnostic biomarker of ellagic acid compound from pomegranate plant (punica granatum) on receptor protein-tyrosine kinase ERBB-2 in identifying breast cancer
Author/Authors
Syamsurizal ، Department of Biology - Faculty of Mathematics and Natural Sciences - Universitas Negeri Padang , Zainul ، Rahadian Department of Chemistry - Faculty of Mathematics and Natural Sciences - Universitas Negeri Padang , Novel ، Dheo Department of Chemistry - Faculty of Mathematics and Natural Sciences - Universitas Negeri Padang , Verawati ، Rismi Department of Chemistry - Faculty of Mathematics and Natural Sciences - Universitas Negeri Padang , Lubis ، Amalia Department of Chemistry - Faculty of Mathematics and Natural Sciences - Universitas Negeri Padang , Mandeli ، Riso Department of Chemistry - Faculty of Mathematics and Natural Sciences - Universitas Negeri Padang , Efroza ، Maurice Department of Metallurgy and Materials Engineering - Faculty of Engineering - University of Indonesia , Ghifari ، Muhammad Department of Information Technology - Faculty of Computer Sciences - Universitas Brawijaya , Azhari ، Putri Department of Agricultural Technology - Faculty of Agricultural Technology - Universitas Andalas , Albari ، Muhammad Department of Information Technology - Faculty of Computer Sciences - Universitas Brawijaya , Rollando ، Rollando Pharmacy Program - Faculty of Health Sciences - Universitas Ma Chung , Ghifari ، Muhammmad Department of Information Technology - Faculty of Computer Sciences - Universitas Brawijaya , Hidayati ، Sari Faculty of Agriculture - Universitas Taman Siswa , Purnamasari ، Devi Department of Radiology - Faculty Health - Universitas Awal Bros , Muhardi ، Muhardi Department of Informatics Engineering - Faculty of Computer Sciences - Universitas Hang Tuah
From page
1097
To page
1108
Abstract
This research aims to develop an effective diagnostic biomarker to identify breast cancer using ellagic acid compound found in pomegranate (Punica granatum) as a specific target. The research method was conducted using Pymol, Pyrex, Protein Plus, and Lepinski Rule software for structural analysis and molecular interactions. The results showed that ellagic acid has a strong binding affinity for the protein-tyrosine kinase receptor ERBB-2, with binding affinity values of -6.7, -6.6, and -6.5 and RMSD of 0, 0.147, and 1.301. In addition, analysis using Protein Plus revealed an interaction between ellagic acid and the protein-tyrosine kinase receptor ERBB-2. Lipinski analysis showed that ellagic acid has a mass of 302, a hydrogen bond donor number of 4, a hydrogen bond acceptor number of 8, a log P of 1.241, and a molar reactivity of 68.454. This discovery has the potential to be an effective diagnostic biomarker in identifying breast cancer, which could help in the early diagnosis and treatment of this disease.
Keywords
diagnostic biomarker , ellagic acid , Pomegranate plant (Punica granatum) , Receptor protein , tyrosine kinase ERBB , 2 , breast cancer
Journal title
Eurasian Chemical Communications
Journal title
Eurasian Chemical Communications
Record number
2763717
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