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Design, Synthesis, Anticancer Evaluation and Molecular Modeling of Novel Estrogen Derivatives
A series of estrone derivatives 3–8 was designed and synthesized using estrone arylmethylenes 2a,b as starting materials and their structures were confirmed by different spectral data and elemental analyses. All the newly synthesized compounds exhibited potent in vitro and in vivo cytotoxic activiti...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2019
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6385123/ https://www.ncbi.nlm.nih.gov/pubmed/30678347 http://dx.doi.org/10.3390/molecules24030416 |
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author | Amr, Abd El-Galil E. Elsayed, Elsayed A. Al-Omar, Mohamed A. Badr Eldin, Hanan O. Nossier, Eman S. Abdallah, Mohamed M. |
author_facet | Amr, Abd El-Galil E. Elsayed, Elsayed A. Al-Omar, Mohamed A. Badr Eldin, Hanan O. Nossier, Eman S. Abdallah, Mohamed M. |
author_sort | Amr, Abd El-Galil E. |
collection | PubMed |
description | A series of estrone derivatives 3–8 was designed and synthesized using estrone arylmethylenes 2a,b as starting materials and their structures were confirmed by different spectral data and elemental analyses. All the newly synthesized compounds exhibited potent in vitro and in vivo cytotoxic activities against breast cancer cell lines. In addition, all compounds were subjected to in vitro and in vivo inhibition assays for EGFR and VEGFR-2 kinases as well as p53 ubiquitination activity to obtain more details about their mechanism of action. Based on the promising results, a molecular docking study was investigated for the most representative compound 5a against the two targets, EGFR and VEGFR-2 kinases, to assess its binding affinity, hoping to rationalize and obtain potent anticancer agents in the future. |
format | Online Article Text |
id | pubmed-6385123 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2019 |
publisher | MDPI |
record_format | MEDLINE/PubMed |
spelling | pubmed-63851232019-02-23 Design, Synthesis, Anticancer Evaluation and Molecular Modeling of Novel Estrogen Derivatives Amr, Abd El-Galil E. Elsayed, Elsayed A. Al-Omar, Mohamed A. Badr Eldin, Hanan O. Nossier, Eman S. Abdallah, Mohamed M. Molecules Article A series of estrone derivatives 3–8 was designed and synthesized using estrone arylmethylenes 2a,b as starting materials and their structures were confirmed by different spectral data and elemental analyses. All the newly synthesized compounds exhibited potent in vitro and in vivo cytotoxic activities against breast cancer cell lines. In addition, all compounds were subjected to in vitro and in vivo inhibition assays for EGFR and VEGFR-2 kinases as well as p53 ubiquitination activity to obtain more details about their mechanism of action. Based on the promising results, a molecular docking study was investigated for the most representative compound 5a against the two targets, EGFR and VEGFR-2 kinases, to assess its binding affinity, hoping to rationalize and obtain potent anticancer agents in the future. MDPI 2019-01-24 /pmc/articles/PMC6385123/ /pubmed/30678347 http://dx.doi.org/10.3390/molecules24030416 Text en © 2019 by the authors. Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (http://creativecommons.org/licenses/by/4.0/). |
spellingShingle | Article Amr, Abd El-Galil E. Elsayed, Elsayed A. Al-Omar, Mohamed A. Badr Eldin, Hanan O. Nossier, Eman S. Abdallah, Mohamed M. Design, Synthesis, Anticancer Evaluation and Molecular Modeling of Novel Estrogen Derivatives |
title | Design, Synthesis, Anticancer Evaluation and Molecular Modeling of Novel Estrogen Derivatives |
title_full | Design, Synthesis, Anticancer Evaluation and Molecular Modeling of Novel Estrogen Derivatives |
title_fullStr | Design, Synthesis, Anticancer Evaluation and Molecular Modeling of Novel Estrogen Derivatives |
title_full_unstemmed | Design, Synthesis, Anticancer Evaluation and Molecular Modeling of Novel Estrogen Derivatives |
title_short | Design, Synthesis, Anticancer Evaluation and Molecular Modeling of Novel Estrogen Derivatives |
title_sort | design, synthesis, anticancer evaluation and molecular modeling of novel estrogen derivatives |
topic | Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6385123/ https://www.ncbi.nlm.nih.gov/pubmed/30678347 http://dx.doi.org/10.3390/molecules24030416 |
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