Characterization of folic acid‐functionalized PLA–PEG nanomicelle to deliver Letrozole: A nanoinformatics study

Abstract Effective cancer treatment is currently the number one challenge to human health. To date, several treatment methods have been introduced for cancer cell targeting. Among the proposed new methods for attacking cancer cells, nanotechnology has attracted much attention. Hence, various nanocar...

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Main Authors: Neda Rostami, Reza Davarnejad
Format: Article
Language:English
Published: Wiley 2022-06-01
Series:IET Nanobiotechnology
Subjects:
Online Access:https://doi.org/10.1049/nbt2.12073
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author Neda Rostami
Reza Davarnejad
author_facet Neda Rostami
Reza Davarnejad
author_sort Neda Rostami
collection DOAJ
description Abstract Effective cancer treatment is currently the number one challenge to human health. To date, several treatment methods have been introduced for cancer cell targeting. Among the proposed new methods for attacking cancer cells, nanotechnology has attracted much attention. Hence, various nanocarriers have been developed for targeted delivery of available drugs and improve their effectiveness against malignant cells. The PLA–PEG functionalised with folic acid (PLA–PEG‐FA) is one of the nanocarriers with a limited range of applications for targeting cancer cells. In this investigation, different types of in‐silico methods such as molecular docking approach, molecular dynamics simulation and free energy calculations are employed to characterise the carriers studied. The effectiveness of PLA–PEG‐FA and PLA–PEG in delivering Letrozole as an aromatase inhibitor in cancer cells is examined. It is found that in the presence of folic acid, the stability and cell membrane permeability of nanomicelle are increased. Therefore, PLA–PEG‐FA can be considered as a versatile carrier that can increase the effectiveness of aromatase inhibitors (such as Letrozole) and reduce their side effects.
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spelling doaj-art-75b48669c02d4b7d88db3a67257016b92025-08-20T03:35:32ZengWileyIET Nanobiotechnology1751-87411751-875X2022-06-0116410311410.1049/nbt2.12073Characterization of folic acid‐functionalized PLA–PEG nanomicelle to deliver Letrozole: A nanoinformatics studyNeda Rostami0Reza Davarnejad1Department of Chemical Engineering, Faculty of Engineering Arak University Arak IranDepartment of Chemical Engineering, Faculty of Engineering Arak University Arak IranAbstract Effective cancer treatment is currently the number one challenge to human health. To date, several treatment methods have been introduced for cancer cell targeting. Among the proposed new methods for attacking cancer cells, nanotechnology has attracted much attention. Hence, various nanocarriers have been developed for targeted delivery of available drugs and improve their effectiveness against malignant cells. The PLA–PEG functionalised with folic acid (PLA–PEG‐FA) is one of the nanocarriers with a limited range of applications for targeting cancer cells. In this investigation, different types of in‐silico methods such as molecular docking approach, molecular dynamics simulation and free energy calculations are employed to characterise the carriers studied. The effectiveness of PLA–PEG‐FA and PLA–PEG in delivering Letrozole as an aromatase inhibitor in cancer cells is examined. It is found that in the presence of folic acid, the stability and cell membrane permeability of nanomicelle are increased. Therefore, PLA–PEG‐FA can be considered as a versatile carrier that can increase the effectiveness of aromatase inhibitors (such as Letrozole) and reduce their side effects.https://doi.org/10.1049/nbt2.12073cancercell membraneLetrozolemolecular dynamicsnanomicelletargeted delivery
spellingShingle Neda Rostami
Reza Davarnejad
Characterization of folic acid‐functionalized PLA–PEG nanomicelle to deliver Letrozole: A nanoinformatics study
IET Nanobiotechnology
cancer
cell membrane
Letrozole
molecular dynamics
nanomicelle
targeted delivery
title Characterization of folic acid‐functionalized PLA–PEG nanomicelle to deliver Letrozole: A nanoinformatics study
title_full Characterization of folic acid‐functionalized PLA–PEG nanomicelle to deliver Letrozole: A nanoinformatics study
title_fullStr Characterization of folic acid‐functionalized PLA–PEG nanomicelle to deliver Letrozole: A nanoinformatics study
title_full_unstemmed Characterization of folic acid‐functionalized PLA–PEG nanomicelle to deliver Letrozole: A nanoinformatics study
title_short Characterization of folic acid‐functionalized PLA–PEG nanomicelle to deliver Letrozole: A nanoinformatics study
title_sort characterization of folic acid functionalized pla peg nanomicelle to deliver letrozole a nanoinformatics study
topic cancer
cell membrane
Letrozole
molecular dynamics
nanomicelle
targeted delivery
url https://doi.org/10.1049/nbt2.12073
work_keys_str_mv AT nedarostami characterizationoffolicacidfunctionalizedplapegnanomicelletodeliverletrozoleananoinformaticsstudy
AT rezadavarnejad characterizationoffolicacidfunctionalizedplapegnanomicelletodeliverletrozoleananoinformaticsstudy