Structure-based and molecular modeling studies for the discovery of cyclic imides as reversible cruzain inhibitors with potent anti-Trypanosoma cruzi activity (2019)
- Authors:
- USP affiliated authors: ANDRICOPULO, RENATA KROGH - IFSC ; ANDRICOPULO, ADRIANO DEFINI - IFSC ; PAULI, IVANÍ - IFSC ; SOUZA, MARIANA LAUREANO DE - IFSC ; FERREIRA, LEONARDO LUIZ GOMES - IFSC ; MAGALHÃES, LUMA GODOY - IFSC
- Unidade: IFSC
- DOI: 10.3389/fchem.2019.00798
- Subjects: DOENÇA DE CHAGAS; TRYPANOSOMA CRUZI; PLANEJAMENTO DE FÁRMACOS
- Keywords: Chagas disease; Trypanosoma cruzi; Cruzain; SAR; Medicinal chemistry; Synthesis; Inhibitors; Molecular docking
- Agências de fomento:
- Language: Inglês
- Imprenta:
- Source:
- Título: Frontiers in Chemistry
- ISSN: 2296-2646
- Volume/Número/Paginação/Ano: v. 7, p. 798-1-798-21, Nov. 2019
- Status:
- Artigo publicado em periódico de acesso aberto (Gold Open Access)
- Versão do Documento:
- Versão publicada (Published version)
- Acessar versão aberta:
-
ABNT
FERREIRA, Rafael A. A. et al. Structure-based and molecular modeling studies for the discovery of cyclic imides as reversible cruzain inhibitors with potent anti-Trypanosoma cruzi activity. Frontiers in Chemistry, v. No 2019, p. 798-1-798-21, 2019Tradução . . Disponível em: https://doi.org/10.3389/fchem.2019.00798. Acesso em: 01 abr. 2026. -
APA
Ferreira, R. A. A., Pauli, I., Sampaio, T. S., Souza, M. L. de, Ferreira, L. L. G., Magalhães, L. G., et al. (2019). Structure-based and molecular modeling studies for the discovery of cyclic imides as reversible cruzain inhibitors with potent anti-Trypanosoma cruzi activity. Frontiers in Chemistry, No 2019, 798-1-798-21. doi:10.3389/fchem.2019.00798 -
NLM
Ferreira RAA, Pauli I, Sampaio TS, Souza ML de, Ferreira LLG, Magalhães LG, Rezende Junior CO, Ferreira RS, Krogh R, Dias LC, Andricopulo AD. Structure-based and molecular modeling studies for the discovery of cyclic imides as reversible cruzain inhibitors with potent anti-Trypanosoma cruzi activity [Internet]. Frontiers in Chemistry. 2019 ; No 2019 798-1-798-21.[citado 2026 abr. 01 ] Available from: https://doi.org/10.3389/fchem.2019.00798 -
Vancouver
Ferreira RAA, Pauli I, Sampaio TS, Souza ML de, Ferreira LLG, Magalhães LG, Rezende Junior CO, Ferreira RS, Krogh R, Dias LC, Andricopulo AD. Structure-based and molecular modeling studies for the discovery of cyclic imides as reversible cruzain inhibitors with potent anti-Trypanosoma cruzi activity [Internet]. Frontiers in Chemistry. 2019 ; No 2019 798-1-798-21.[citado 2026 abr. 01 ] Available from: https://doi.org/10.3389/fchem.2019.00798 - Multiparameter optimization of Trypanocidal cruzain inhibitors with in vivo activity and favorable pharmacokinetics
- Carbamoylimidazoles as potent cruzain inhibitors with in vitro and in vivo trypanocidal activity: a structure-based drug design approach
- Discovery of potent, reversible, and competitive cruzain inhibitors with trypanocidal activity: a structure-based drug design approach
- Synthesis and anti-trypanosoma cruzi activity of 3-cyanopyridine derivatives
- Discovery of highly potent and selective antiparasitic new oxadiazole and hydroxy-oxindole small molecule hybrids
- Antitrypanosomal aminobenzimidazoles: hit to lead expansion of new chemical entities against Trypanosoma cruzi and Leishmania infantum
- Chalcones and their B-aryl analogues as myeloperoxidase inhibitors: in silico, in vitro and ex vivo investigations
- QSAR and molecular docking for a series of inhibitors of the enzyme cruzain from Trypanosoma cruzi
- Chemoinformatics studies on a series of imidazoles as cruzain inhibitors
- Otimização da síntese, separação enantiomérica e determinação da configuração de enantiômeros de acridinona com atividade anticâncer
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