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Bioorg Med Chem ; 21(11): 2826-31, 2013 Jun 01.
Artículo en Inglés | MEDLINE | ID: mdl-23623712

RESUMEN

Cyanobacterial fructose-1,6-/sedoheptulose-1,7-bisphoshatase (Cy-FBP/SBPase) is an important target enzyme for finding inhibitors to solve harmful algal bloom (HAB). In this study, as potential inhibitors of Cy-FBP/SBPase, a series of novel chromone-connecting benzohydrazone compounds (Novel N'-((4-oxo-4H-chromen-3-yl)methylene)benzohydrazide) were designed and synthesized. Their inhibitory activities against Cy-FBP/SBPase were further examined in vitro. Some of these compounds, such as f6-f8, f11, f12 and f16, exhibit higher inhibitory activities (IC50=11.2-16.1 µM), especially, the compound f7 was identified as the most potent inhibitor with IC50 value of 11.2 µM. The probable binding-mode of compound f7 was further analyzed carefully by molecular docking methods. These results indicate that compound f7 could be used as a lead compound for further optimization and might have potential to be developed as a new algicide.


Asunto(s)
Antibacterianos/síntesis química , Proteínas Bacterianas/antagonistas & inhibidores , Cromonas/síntesis química , Cianobacterias/química , Fructosa-Bifosfatasa/antagonistas & inhibidores , Hidrazonas/síntesis química , Monoéster Fosfórico Hidrolasas/antagonistas & inhibidores , Antibacterianos/química , Proteínas Bacterianas/química , Proteínas Bacterianas/genética , Cromonas/química , Cianobacterias/enzimología , Diseño de Fármacos , Escherichia coli/genética , Fructosa-Bifosfatasa/química , Fructosa-Bifosfatasa/genética , Hidrazonas/química , Simulación del Acoplamiento Molecular , Monoéster Fosfórico Hidrolasas/química , Monoéster Fosfórico Hidrolasas/genética , Proteínas Recombinantes/química , Proteínas Recombinantes/genética
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