Molecular design aided by random forests and synthesis of potent trypanocidal agents as cruzain inhibitors for Chagas disease treatment (2020)
- Authors:
- USP affiliated authors: ALBUQUERQUE, SÉRGIO DE - FCFRP ; LEITÃO, ANDREI - IQSC ; MONTANARI, CARLOS ALBERTO - IQSC ; SILVA, JOÃO SANTANA DA - FMRP ; LOPES, CARLA DUQUE - EESC ; CIANNI, LORENZO - IQSC ; VITA, DANIELA DE - IQSC ; MONTANARI, RAPHAEL - ICMC ; RIBEIRO, JEAN FRANCISCO ROSA - IQSC
- Unidades: FCFRP; IQSC; FMRP; EESC; ICMC
- DOI: 10.1111/cbdd.13663
- Subjects: DOENÇA DE CHAGAS; TRYPANOSOMA CRUZI
- Keywords: cruzain; machine learning; oral bioavailability; random forests
- Agências de fomento:
- Language: Inglês
- Imprenta:
- Source:
- Título: Chemical Biology & Drug Design
- ISSN: 1747-0277
- Volume/Número/Paginação/Ano: v. 96, p. 948–960, October 2020
- Este periódico é de assinatura
- Este artigo NÃO é de acesso aberto
- Cor do Acesso Aberto: closed
-
ABNT
ALBUQUERQUE, Sérgio de et al. Molecular design aided by random forests and synthesis of potent trypanocidal agents as cruzain inhibitors for Chagas disease treatment. Chemical Biology & Drug Design, v. 96, p. 948–960, 2020Tradução . . Disponível em: https://doi.org/10.1111/cbdd.13663. Acesso em: 28 dez. 2025. -
APA
Albuquerque, S. de, Cianni, L., Vita, D. de, Lopes, C. D., Gomes, A. S. M., Gomes, P., et al. (2020). Molecular design aided by random forests and synthesis of potent trypanocidal agents as cruzain inhibitors for Chagas disease treatment. Chemical Biology & Drug Design, 96, 948–960. doi:10.1111/cbdd.13663 -
NLM
Albuquerque S de, Cianni L, Vita D de, Lopes CD, Gomes ASM, Gomes P, Laughton C, Leitão A, Montanari CA, Montanari R, Ribeiro JFR, Silva JS da, Teixeira C. Molecular design aided by random forests and synthesis of potent trypanocidal agents as cruzain inhibitors for Chagas disease treatment [Internet]. Chemical Biology & Drug Design. 2020 ; 96 948–960.[citado 2025 dez. 28 ] Available from: https://doi.org/10.1111/cbdd.13663 -
Vancouver
Albuquerque S de, Cianni L, Vita D de, Lopes CD, Gomes ASM, Gomes P, Laughton C, Leitão A, Montanari CA, Montanari R, Ribeiro JFR, Silva JS da, Teixeira C. Molecular design aided by random forests and synthesis of potent trypanocidal agents as cruzain inhibitors for Chagas disease treatment [Internet]. Chemical Biology & Drug Design. 2020 ; 96 948–960.[citado 2025 dez. 28 ] Available from: https://doi.org/10.1111/cbdd.13663 - Mapping the S1 and S1’ subsites of cysteine proteases with new dipeptidyl nitrile inhibitors as trypanocidal agents
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- N-Sulfonyl dipeptide nitriles as inhibitors of human cathepsin S: In silico design, synthesis and biochemical characterization
- Dipeptidyl nitrile derivatives have cytostatic effects against Leishmania spp. promastigotes
- Molecular design, synthesis and trypanocidal activity of dipeptidyl nitriles as cruzain inhibitors
- Assessment of the Cruzain Cysteine Protease Reversible and Irreversible Covalent Inhibition Mechanism
- Integration of methods in cheminformatics and biocalorimetry for the design of trypanosomatid enzyme inhibitors
- On the intrinsic reactivity of highly potent trypanocidal cruzain inhibitors
- Molecular design, synthesis and biolgical evaluation of 1,4-dihydro-4-oxoquinoline ribonucleosides as TcGAPDH inhibitors with trypanocidal acitivity
Informações sobre o DOI: 10.1111/cbdd.13663 (Fonte: oaDOI API)
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