Design and synthesis of two azete-phenylene-dibenzoic acid derivatives and theoretical evaluation of their interaction with BRCA-1 protein

Figueroa Valverde Lauro, Diaz Cedillo Francisco, Rosas Nexticapa Marcela, Mateu Armand Virginia, Montano Tapia Elizabeth, Hau Heredia Lenin, Lopez Ramos Maria, García Cervera Elodia, Pool Gómez Eduardo, García Martinez Rolando, Estrella Barrón Raquel, Cauich Carrillo Regina, Alfonso Jimenez Alondra, Cabrera Tuz Jhair

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Resumen

Several compounds have been prepared to the treatment of breast cancer; however, some of these drugs may produce some adverse effects. The objective of this investigation carried out the synthesis of two azete-phenylene-dibenzoic acid derivatives (compounds 4 or 5) and analyze its theoretical interaction with the BRCA-1 protein surface. The preparation of 4 and 5 was carried out using a series of reactions which involves; i) addition (2 + 2); ii) etherification and iii) formation of allylamino groups. Chemical structure of azete derivatives was carried out using elemental analysis and nuclear magnetic resonance spectra. The following stage involved the theoretical evaluation of the interaction of both compounds 7 or 8 with BRCA-1 protein surface using a docking model. The results showed that compound 4 could bound to the different type of aminoacid residues of BRCA-1 protein compared with 5. All these data indicate that both compounds could be an alternative therapy for treatment of breast cancer via BRCA-1 protein inhibition.

Idioma originalInglés
Páginas (desde-hasta)3412-3417
Número de páginas6
PublicaciónBiointerface Research in Applied Chemistry
Volumen8
N.º4
EstadoPublicada - 15 ago. 2018

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