Ultrasound-assisted green synthesis of triazole-based azomethine/thiazolidin-4-one hybrid inhibitors for cancer therapy through targeting dysregulation signatures of some Rab proteins
ABSTRACTThe overexpression of Rab proteins was linked to cancer development, making this family of proteins an attractive drug target for the identification of novel inhibitors against tumor diseases. In this study, novel triazole-based azomethine/thiazolidin-4-one hybrid analogs were designed, prep...
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| Format: | Article |
| Language: | English |
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Taylor & Francis Group
2023-01-01
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| Series: | Green Chemistry Letters and Reviews |
| Subjects: | |
| Online Access: | https://www.tandfonline.com/doi/10.1080/17518253.2022.2150394 |
| _version_ | 1797450033573920768 |
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| author | Aboubakr H. Abdelmonsef Ahmed M. El-Saghier Asmaa M. Kadry |
| author_facet | Aboubakr H. Abdelmonsef Ahmed M. El-Saghier Asmaa M. Kadry |
| author_sort | Aboubakr H. Abdelmonsef |
| collection | DOAJ |
| description | ABSTRACTThe overexpression of Rab proteins was linked to cancer development, making this family of proteins an attractive drug target for the identification of novel inhibitors against tumor diseases. In this study, novel triazole-based azomethine/thiazolidin-4-one hybrid analogs were designed, prepared and structurally confirmed by using elemental and spectral techniques, these include FT-IR, MS, and NMR spectra. In addition, in vitro cytotoxic activity was assessed against NCI-60 cancer cell lines. To understand the possible mode of action and drugability, molecular docking studies and drug-likeness were achieved. The docking simulations were performed against various Rab family proteins Rab2a, Rab25, Rab5, and Rab35; promising targets for cancer medication to support the cytotoxicity findings and to further validate the action of new molecules. Furthermore, in silico ADMET screening of the molecules was within the recommended values stated by Lipinski's rule of five (Ro5), indicating their oral bioavailability and therapeutic potentials. Among the newly prepared analogs tested, compounds 4d and 3d exhibited significant antitumor activity against breast, ovarian, lung, and leukemia cancer cell lines. Our findings suggested that azomethine/thiazolidin-4-one moieties incorporated triazole analogs are a promising class of molecular entities for the development of new anticancer therapies, through targeting of some Rab proteins. |
| first_indexed | 2024-03-09T14:34:39Z |
| format | Article |
| id | doaj.art-68dc0fc40cf34d7c87e6997797b52483 |
| institution | Directory Open Access Journal |
| issn | 1751-8253 1751-7192 |
| language | English |
| last_indexed | 2024-03-09T14:34:39Z |
| publishDate | 2023-01-01 |
| publisher | Taylor & Francis Group |
| record_format | Article |
| series | Green Chemistry Letters and Reviews |
| spelling | doaj.art-68dc0fc40cf34d7c87e6997797b524832023-11-27T14:52:10ZengTaylor & Francis GroupGreen Chemistry Letters and Reviews1751-82531751-71922023-01-0116110.1080/17518253.2022.2150394Ultrasound-assisted green synthesis of triazole-based azomethine/thiazolidin-4-one hybrid inhibitors for cancer therapy through targeting dysregulation signatures of some Rab proteinsAboubakr H. Abdelmonsef0Ahmed M. El-Saghier1Asmaa M. Kadry2Chemistry Department, Faculty of Science, South Valley University, Qena, EgyptChemistry Department, Faculty of Science, Sohag University, Sohag, EgyptChemistry Department, Faculty of Science, Sohag University, Sohag, EgyptABSTRACTThe overexpression of Rab proteins was linked to cancer development, making this family of proteins an attractive drug target for the identification of novel inhibitors against tumor diseases. In this study, novel triazole-based azomethine/thiazolidin-4-one hybrid analogs were designed, prepared and structurally confirmed by using elemental and spectral techniques, these include FT-IR, MS, and NMR spectra. In addition, in vitro cytotoxic activity was assessed against NCI-60 cancer cell lines. To understand the possible mode of action and drugability, molecular docking studies and drug-likeness were achieved. The docking simulations were performed against various Rab family proteins Rab2a, Rab25, Rab5, and Rab35; promising targets for cancer medication to support the cytotoxicity findings and to further validate the action of new molecules. Furthermore, in silico ADMET screening of the molecules was within the recommended values stated by Lipinski's rule of five (Ro5), indicating their oral bioavailability and therapeutic potentials. Among the newly prepared analogs tested, compounds 4d and 3d exhibited significant antitumor activity against breast, ovarian, lung, and leukemia cancer cell lines. Our findings suggested that azomethine/thiazolidin-4-one moieties incorporated triazole analogs are a promising class of molecular entities for the development of new anticancer therapies, through targeting of some Rab proteins.https://www.tandfonline.com/doi/10.1080/17518253.2022.2150394Triazoleazomethinethiazolidin-4-onehybrid moleculesRab proteinsanticancer |
| spellingShingle | Aboubakr H. Abdelmonsef Ahmed M. El-Saghier Asmaa M. Kadry Ultrasound-assisted green synthesis of triazole-based azomethine/thiazolidin-4-one hybrid inhibitors for cancer therapy through targeting dysregulation signatures of some Rab proteins Green Chemistry Letters and Reviews Triazole azomethine thiazolidin-4-one hybrid molecules Rab proteins anticancer |
| title | Ultrasound-assisted green synthesis of triazole-based azomethine/thiazolidin-4-one hybrid inhibitors for cancer therapy through targeting dysregulation signatures of some Rab proteins |
| title_full | Ultrasound-assisted green synthesis of triazole-based azomethine/thiazolidin-4-one hybrid inhibitors for cancer therapy through targeting dysregulation signatures of some Rab proteins |
| title_fullStr | Ultrasound-assisted green synthesis of triazole-based azomethine/thiazolidin-4-one hybrid inhibitors for cancer therapy through targeting dysregulation signatures of some Rab proteins |
| title_full_unstemmed | Ultrasound-assisted green synthesis of triazole-based azomethine/thiazolidin-4-one hybrid inhibitors for cancer therapy through targeting dysregulation signatures of some Rab proteins |
| title_short | Ultrasound-assisted green synthesis of triazole-based azomethine/thiazolidin-4-one hybrid inhibitors for cancer therapy through targeting dysregulation signatures of some Rab proteins |
| title_sort | ultrasound assisted green synthesis of triazole based azomethine thiazolidin 4 one hybrid inhibitors for cancer therapy through targeting dysregulation signatures of some rab proteins |
| topic | Triazole azomethine thiazolidin-4-one hybrid molecules Rab proteins anticancer |
| url | https://www.tandfonline.com/doi/10.1080/17518253.2022.2150394 |
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