A study on the toxic mechanisms of tert-butylhydroquinone, butylated hydroxytoluene, and ethoxyquin in endometrial cancer, cervical cancer, and ovarian cancer based on network toxicology and molecular docking technology

Using network toxicology and molecular docking, we systematically explain how the food additives TBHQ, BHT and EQ cause harmful effects in endometrial, cervical and ovarian cancers. We focus on the key molecular steps, core targets and signaling pathways involved. ProTox-3.0 predicted toxicity; GeneCards/OMIM extracted disease targets; GO/KEGG enrichment, PPI network, and molecular docking analyzed core targets and pathways. mRNA-miRNA-lncRNA regulatory networks and pan-cancer gene expression were further explored. TBHQ/BHT/EQ showed potential carcinogenic risks (Activity Scores: 0.77/0.96/0.79). Core targets included IL6, PTGS2, ESR1, and HSP90AA1, involving cancer, cAMP, and calcium signaling pathways. Molecular docking predicted moderate binding affinities (e.g., EQ-HSP90AA1: − 5.76 kcal/mol). TBHQ/BHT/EQ may exert toxic effects on gynecological cancers via specific targets and pathways, providing support for food additive safety assessment.

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Publication Details

Journal
Discover Oncology
Published
2026-10-14
DOI
https://doi.org/10.1007/s12672-026-06061-2
Primary Topic
Computational Drug Discovery Methods
Type
article
Field-Weighted Citation Impact
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article

A study on the toxic mechanisms of tert-butylhydroquinone, butylated hydroxytoluene, and ethoxyquin in endometrial cancer, cervical cancer, and ovarian cancer based on network toxicology and molecular docking technology

Haibo Wang, Li Liu, Keqing Yuan, Lili Zhou et al.
Discover Oncology
Computational Drug Discovery Methods
article

A study on the toxic mechanisms of tert-butylhydroquinone, butylated hydroxytoluene, and ethoxyquin in endometrial cancer, cervical cancer, and ovarian cancer based on network toxicology and molecular docking technology

Haibo Wang, Li Liu, Keqing Yuan, Lili Zhou, Junbo Liu, Yufei Cui, Changhui Li
article en

Abstract

Using network toxicology and molecular docking, we systematically explain how the food additives TBHQ, BHT and EQ cause harmful effects in endometrial, cervical and ovarian cancers. We focus on the key molecular steps, core targets and signaling pathways involved. ProTox-3.0 predicted toxicity; GeneCards/OMIM extracted disease targets; GO/KEGG enrichment, PPI network, and molecular docking analyzed core targets and pathways. mRNA-miRNA-lncRNA regulatory networks and pan-cancer gene expression were further explored. TBHQ/BHT/EQ showed potential carcinogenic risks (Activity Scores: 0.77/0.96/0.79). Core targets included IL6, PTGS2, ESR1, and HSP90AA1, involving cancer, cAMP, and calcium signaling pathways. Molecular docking predicted moderate binding affinities (e.g., EQ-HSP90AA1: − 5.76 kcal/mol). TBHQ/BHT/EQ may exert toxic effects on gynecological cancers via specific targets and pathways, providing support for food additive safety assessment.

Discover Oncology
Tohoku University (JP), Changchun University of Chinese Medicine (CN), Jilin Medical University (CN), The Affiliated Hospital to Changchun University of Chinese Medicine (CN)
Good health and well-being
Openalex Percentile: Top 14%
Computational Drug Discovery Methods
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