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1. Discovery of novel indole derivatives as allosteric inhibitors of fructose-1,6-bisphosphatase.

Author

Bie, Jianbo, Liu, Shuainan, Li, Zhanmei, Mu, Yongzhao, Xu, Bailing, and Shen, Zhufang

Subjects
*DRUG development, *DRUG design, *INDOLE derivatives, *FRUCTOSE-2,6-bisphosphate, *ENZYME inhibitors, *ALLOSTERIC enzymes
Abstract

A series of novel indole derivatives was designed and synthesized as inhibitors of fructose-1,6-bisphosphatase (FBPase). The most potent compound 14c was identified with an IC 50 value of 0.10 μM by testing the inhibitory activity against recombinant human FBPase. The structure-activity relationships were investigated on the substitution at 4- and 5-position of the indole scaffold. The binding interactions of the title compounds at AMP binding site of FBPase were predicted using CDOCKER algorithm. [ABSTRACT FROM AUTHOR]

Published
2015
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