2021
DOI: 10.1080/07391102.2021.1953603
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In silico approach to target PI3K/Akt/mTOR axis by selected Olea europaea phenols in PIK3CA mutant colorectal cancer

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Cited by 9 publications
(7 citation statements)
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“…32 In addition, the results were consistent with previous research that indicated that the phenolic compounds (pinoresinol, apigenin, luteolin, o. aglycone, and oleuropein) derived from Olea europaea showed binding affinities towards PI3K, Akt, and mTOR. 22 Even though TQ showed a slightly higher free binding energy than the positive controls selected in this study, it showed a multi-targeted tyrosine kinase inhibitory effect by inhibiting the enzymatic activities of several tyrosine kinases with low side effects compared to the currently available TKIs. Interestingly, these results indicate promising potential effects of TQ acting as a multi-targeted TKI for several tyrosine kinases involved in the pathogenesis of leukaemia.…”
Section: Resultsmentioning
confidence: 67%
See 1 more Smart Citation
“…32 In addition, the results were consistent with previous research that indicated that the phenolic compounds (pinoresinol, apigenin, luteolin, o. aglycone, and oleuropein) derived from Olea europaea showed binding affinities towards PI3K, Akt, and mTOR. 22 Even though TQ showed a slightly higher free binding energy than the positive controls selected in this study, it showed a multi-targeted tyrosine kinase inhibitory effect by inhibiting the enzymatic activities of several tyrosine kinases with low side effects compared to the currently available TKIs. Interestingly, these results indicate promising potential effects of TQ acting as a multi-targeted TKI for several tyrosine kinases involved in the pathogenesis of leukaemia.…”
Section: Resultsmentioning
confidence: 67%
“…Molecular docking is commonly used in silico method for ligand-protein interaction which is used to find new inhibitors of tyrosine kinases involved in several signalling pathways and to reveal the possible mechanisms of action of both previously identified compounds and new drugs for cancer therapies. 22,23 TKIs represent innovative therapy for various types of cancers. Therefore, identifying TKIs from natural sources is a promising approach for the identification of new TKIs.…”
Section: Introductionmentioning
confidence: 99%
“…Growing evidence proved that Wogonin ( Ming et al, 2020 ), Pinoresinol ( Sain et al, 2021 ) , Secoisolariciresionol ( Ozgocmen et al, 2021 ) , and Vanillic acid ( Gong et al, 2019b ) have a high potential to tackle gastrointestinal cancer through regulating cell cycle arrest, cellular senescence, autophagy, as well as inhibiting angiogenesis via multiple mechanisms.…”
Section: Antitumor Effects and Corresponding Mechanismsmentioning
confidence: 99%
“…The 3D crystal structure was cleared of any water molecule, ligand group, or any other kind of heteroatom present. Polar hydrogen and gasteiger charges were added to stabilize the protein crystal structure and make it ready for molecular docking (18).…”
Section: Protein Target Preparationmentioning
confidence: 99%