Tapping into the antitubercular potential of 2,5-dimethylpyrroles: A structure-activity relationship interrogation

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MetadadosDescriçãoIdioma
Autor(es): dc.contributorKing's College London-
Autor(es): dc.contributorUniversidade Estadual Paulista (UNESP)-
Autor(es): dc.contributorUniversity of Siena-
Autor(es): dc.creatorSemenya, Dorothy-
Autor(es): dc.creatorTouitou, Meir-
Autor(es): dc.creatorMasci, Domiziana-
Autor(es): dc.creatorRibeiro, Camila Maringolo-
Autor(es): dc.creatorPavan, Fernando Rogerio-
Autor(es): dc.creatorDos Santos Fernandes, Guilherme Felipe-
Autor(es): dc.creatorGianibbi, Beatrice-
Autor(es): dc.creatorManetti, Fabrizio-
Autor(es): dc.creatorCastagnolo, Daniele-
Data de aceite: dc.date.accessioned2025-08-21T23:44:03Z-
Data de disponibilização: dc.date.available2025-08-21T23:44:03Z-
Data de envio: dc.date.issued2023-03-02-
Data de envio: dc.date.issued2023-03-02-
Data de envio: dc.date.issued2022-07-05-
Fonte completa do material: dc.identifierhttp://dx.doi.org/10.1016/j.ejmech.2022.114404-
Fonte completa do material: dc.identifierhttp://hdl.handle.net/11449/241827-
Fonte: dc.identifier.urihttp://educapes.capes.gov.br/handle/11449/241827-
Descrição: dc.descriptionAn exploration of the chemical space around a 2,5-dimethylpyrrole scaffold of antitubercular hit compound 1 has led to the identification of new derivatives active against Mycobacterium tuberculosis and multidrug-resistant clinical isolates. Analogues incorporating a cyclohexanemethyl group on the methyleneamine side chain at C3 of the pyrrole core, including 5n and 5q, exhibited potent inhibitory effects against the M. tuberculosis strains, substantiating the essentiality of the moiety to their antimycobacterial activity. In addition, selected derivatives showed promising cytotoxicity profiles against human pulmonary fibroblasts and/or murine macrophages, proved to be effective in inhibiting the growth of intracellular mycobacteria, and elicited either bactericidal effects, or bacteriostatic activity comparable to 1. Computational studies revealed that the new compounds bind to the putative target, MmpL3, in a manner similar to that of known inhibitors BM212 and SQ109.-
Descrição: dc.descriptionFundação de Amparo à Pesquisa do Estado de São Paulo (FAPESP)-
Descrição: dc.descriptionSchool of Cancer and Pharmaceutical Sciences King's College London, 150 Stamford Street-
Descrição: dc.descriptionTuberculosis Research Laboratory School of Pharmaceutical Sciences Sao Paulo State University (UNESP), Rod. Araraquara-Jau, km1-
Descrição: dc.descriptionDipartimento di Biotecnologie Chimica e Farmacia Dipartimento di Eccellenza 2018-2022 University of Siena, via A. Moro 2-
Descrição: dc.descriptionTuberculosis Research Laboratory School of Pharmaceutical Sciences Sao Paulo State University (UNESP), Rod. Araraquara-Jau, km1-
Descrição: dc.descriptionFAPESP: 2020/13497-4-
Idioma: dc.languageen-
Relação: dc.relationEuropean Journal of Medicinal Chemistry-
???dc.source???: dc.sourceScopus-
Palavras-chave: dc.subjectAntimicrobial resistance-
Palavras-chave: dc.subjectAntimycobacterial-
Palavras-chave: dc.subjectMDR-TB-
Palavras-chave: dc.subjectPyrrole-
Palavras-chave: dc.subjectSAR-
Palavras-chave: dc.subjectTuberculosis-
Título: dc.titleTapping into the antitubercular potential of 2,5-dimethylpyrroles: A structure-activity relationship interrogation-
Tipo de arquivo: dc.typelivro digital-
Aparece nas coleções:Repositório Institucional - Unesp

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