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Bioorg Med Chem Lett ; 27(16): 3840-3844, 2017 08 15.
Artigo em Inglês | MEDLINE | ID: mdl-28668193

RESUMO

Two diastereomeric analogs (1 and 2) of diaminopimelic acid (DAP) bearing an isoxazoline moiety were synthesized and evaluated for their inhibitory activities against meso-diaminopimelate dehydrogenase (m-Ddh) from the periodontal pathogen, Porphyromonas gingivalis. Compound 2 showed promising inhibitory activity against m-Ddh with an IC50 value of 14.9µM at pH 7.8. The two compounds were further tested for their antibacterial activities against a panel of periodontal pathogens, and compound 2 was shown to be selectively potent to P. gingivalis strains W83 and ATCC 33277 with minimum inhibitory concentration (MIC) values of 773µM and 1.875mM, respectively. Molecular modeling studies revealed that the inversion of chirality at the C-5 position of these compounds was the primary reason for their different biological profiles. Based on these preliminary results, we believe that compound 2 has properties consistent with it being a lead compound for developing novel pathogen selective antibiotics to treat periodontal diseases.


Assuntos
Aminoácido Oxirredutases/antagonistas & inibidores , Antibacterianos/farmacologia , Ácido Diaminopimélico/farmacologia , Inibidores Enzimáticos/farmacologia , Isoxazóis/farmacologia , Porphyromonas gingivalis/efeitos dos fármacos , Aminoácido Oxirredutases/metabolismo , Antibacterianos/síntese química , Antibacterianos/química , Ácido Diaminopimélico/síntese química , Ácido Diaminopimélico/química , Relação Dose-Resposta a Droga , Inibidores Enzimáticos/síntese química , Inibidores Enzimáticos/química , Isoxazóis/química , Testes de Sensibilidade Microbiana , Modelos Moleculares , Estrutura Molecular , Porphyromonas gingivalis/enzimologia , Relação Estrutura-Atividade
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