Evidence map›Paper›PMID 39159487›Full record

ArticleJournal of medicinal chemistry2024

Examining Hemin and its Derivatives: Induction of Heme-Oxygenase-1 Activity and Oxidative Stress in Breast Cancer Cells through Collaborative Experimental Analysis and Molecular Dynamics Simulations.

Amir M Alsharabasy, Panagiotis I Lagarias, Konstantinos D Papavasileiou, Antreas Afantitis, Pau Farràs, Sharon Glynn, Abhay Pandit

Abstract read
In one paragraph

Article in Journal of medicinal chemistry, 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 5 papers.

0numbers the graph read from it
0cells of the map it votes in
5citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

5 citing papers in PubMed.

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4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

7 authors.

Amir M AlsharabasyCÚRAM, SFI Research Centre for Medical Devices, University of Galway, Galway H91 W2TY, Ireland.ORCID 0000-0002-8503-5549
Panagiotis I LagariasDepartment of ChemoInformatics, Novamechanics Ltd., Nicosia 1070, Cyprus.
Konstantinos D PapavasileiouDepartment of ChemoInformatics, Novamechanics Ltd., Nicosia 1070, Cyprus.ORCID 0000-0002-2322-7422
Antreas AfantitisDepartment of ChemoInformatics, Novamechanics Ltd., Nicosia 1070, Cyprus.ORCID 0000-0002-0977-8180
Pau FarràsCÚRAM, SFI Research Centre for Medical Devices, University of Galway, Galway H91 W2TY, Ireland.ORCID 0000-0003-3859-2868
Sharon GlynnCÚRAM, SFI Research Centre for Medical Devices, University of Galway, Galway H91 W2TY, Ireland.
Abhay PanditCÚRAM, SFI Research Centre for Medical Devices, University of Galway, Galway H91 W2TY, Ireland.ORCID 0000-0002-6292-4933

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

Hemin triggers intracellular reactive oxygen species (ROS) accumulation and enhances heme oxygenase-1 (HOX-1) activity, indicating its potential as an anticancer agent, though precise control of its intracellular levels is crucial. The study explores the impact of hemin and its derivatives, hemin-tyrosine, and hemin-styrene (H-Styr) conjugates on migration, HOX-1 expression, specific apoptosis markers, mitochondrial functions, and ROS generation in breast cancer cells. Molecular docking and dynamics simulations were used to understand the interactions among HOX-1, heme, and the compounds. Hemin outperforms its derivatives in inducing HOX-1 expression, exhibiting pro-oxidative effects and reducing cell migration. Molecular simulations show that heme binds favorably to HOX-1, followed by the other compounds, primarily through van der Waals and electrostatic forces. However, only van der Waals forces determine the H-Styr complexation. These interactions, influenced by metalloporphyrin characteristics, provide insights into HOX-1 regulation and ROS generation, potentially guiding the development of breast cancer therapies targeting oxidative stress.

Indexed as

Breast NeoplasmsHeme Oxygenase-1HeminMolecular Dynamics SimulationOxidative StressReactive Oxygen SpeciesAntineoplastic AgentsApoptosisCell Line, TumorCell MovementFemaleHumansMolecular Docking SimulationAntineoplastic AgentsHeme Oxygenase-1HeminReactive Oxygen Species

Identifiers

PMID39159487
PMCPMC11403666

What OpenQuestion holds

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Registered trials

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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.