Synthesis of novel substituted quinoline derivatives as diabetics II inhibitors and along with their in-silico studies

喹啉 化学 阿卡波糖 生物信息学 立体化学 IC50型 活动站点 活性化合物 酶抑制 组合化学 阳性对照 体外 生物化学 有机化学 传统医学 基因 医学
作者
Satya Kumar Avula,Saeed Ullah,Sobia Ahsan Halim,Ajmal Khan,Muhammad U. Anwar,René Csuk,Ahmed Al‐Harrasi
出处
期刊:Journal of Molecular Structure [Elsevier]
卷期号:1274: 134560-134560 被引量:3
标识
DOI:10.1016/j.molstruc.2022.134560
摘要

In this article, 26 compounds of substituted quinoline derivatives were synthesized and their α-glucosidase inhibition activity against the α-glucosidase enzyme was investigated. The screening results revealed that most of the synthesized substituted quinoline compounds demonstrated moderate to very good α-glucosidase inhibitory activity when compared to the first-line drug Acarbose (standard). The IC50 values were obtained in the range of 21.71–375.00 µM. Amongst the substituted functionalized quinoline derivatives, compounds 10b, 10d, 11c-11d, 17b-17c, and 18c-18d displayed very promising results. The single crystal X-ray diffraction of compound 12 unambiguously confirmed its structure. This study has unravelled a new series of substituted quinoline derivatives as good inhibitors of α-glucosidase enzyme. All the active hits were docked in the active site of α-glucosidase to investigate their mode of binding. We conclude that the newly introduced substituents are important for interaction affecting as they demonstrate the potential of these compounds for α-glucosidase inhibitors.

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