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Integrated in vivo and in silico validation of Corchorus olitorius seed-mediated cardioprotection against doxorubicin-induced cardiotoxicity via network pharmacology; molecular docking; and molecular dynamics

delete2026-08-01
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OA
AI
F
Fatma Mohamed Abd El‐Mordy
S
SA Sherif A. Maher
O
OY Omar Y. Tammam
M
Mahmoud A. Elrehany
M
Mohamed Hisham
R
RR Remon R. Rofaeil
M
ME Mostafa E. Rateb
H
HF Hesham F. Oraby
M
Mahmoud A. A. Ibrahim
A
AM Ahmed M. Shawky
G
Gerhard Bringmann
U
UR Usama Ramadan Abdelmohsen *
N
Nourhan Hisham Shady *
DOI:10.3389/fchem.2026.1810825delete
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Abstract

Abstract

En 中文
BackgroundCorchorus olitorius L.; known in Arab countries as molokhia; is a leafy plant rich in many carotenoids; minerals; and vitamins; its seeds are also reported to offer cardioprotective effects. Although the cardioprotective effects of molokhia are ascribed to the presence of cardiac glycoside compounds; the exact action mechanisms remain uninvestigated.MethodsIn this study; we examined the potential of molokhia seeds to protect against cardiopathy by isolating the major constituents of C. olitorius seeds; analyzing its gene expression in vivo; and conducting computational studies to demonstrate the cardioprotective activities of these constituents.ResultsCrude extracts of C. olitorius seeds were found to reduce the expression of IL-1β; IL-6; TNF-α; NF-κB; ICAM-1; and MMP-9 that had increased upon the administration of doxorubicin (DOX). Electrocardiographic studies showed reduced heart rate along with prolongation of the PR interval; QRS complex; and ST segment upon Corchorus administration.ConclusionThe findings of this study demonstrate that the cardioprotective effects of molokhia seeds against DOX-induced cardiotoxicity are probably mediated via anti-inflammatory actions.
Keywords:
molecular docking
network pharmacology
NF-κB
AKT1
cardioprotection
doxorubicin-induced cardiotoxicity
cardiac glycosides
Corchorus olitorius

Journal

Frontiers in Chemistry cover
Frontiers in Chemistry
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4.2
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3.2W

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Institute of Organic Chemistry
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Department of Pharmacognosy
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natural and medical sciences research center
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Department of Pharmaceutical Chemistry
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school of health sciences
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Department of Biochemistry
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Department of Chemistry
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department of pharmacognosy and medicinal plants
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Department of Pharmacology
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