Ufa Institute of Chemistry, Ufa Federal Research Centre of RAS, Ufa, 450054, Russian Federation.
School of Pharmacy, China Medical University, Taichung, 40402, Taiwan.
Virus Res. 2021 Mar;294:198290. doi: 10.1016/j.virusres.2020.198290. Epub 2020 Dec 31.
Zika virus (ZIKV) is a new pathogenic flavivirus transmitted by mosquitoes Aedes spp. ZIKV infection is accompanied by serious neurological complications and is especially dangerous for pregnant women, in which it can lead to congenital malformations of the fetus and microcephaly in neonates. Currently, there are no licensed vaccines or specific post-infectious therapies for ZIKV infection. This report is devoted to the study of glycyrrhizic acid (GL) derivatives as ZIKV inhibitors. The inhibitory assays on the cytopathic effect (CPE) and viral infectivity of ZIKV in three different human cell lines revealed that the conjugation of GL with amino acids and their esters (methyl, ethyl) is influenced by the antiviral activity of the compounds. GL conjugates with Glu(OMe)-OMe 11, Glu(OH)-OMe 12, Asp(OMe)-OMe 13, TyrOMe 14, LeuOEt 15, and PheOEt 16 with free COOH groups in the triterpene moiety were active against ZIKV. The most active compounds 13 and 14 have IC50 values of 0.23 μM and 0.09 μM against low doses (MOI = 0.05) of ZIKV strain PRVABC59, 1.20 μM and 0.74 μM against high doses (MOI = 10) of ZIKV strain Natal RGN single-round infectious particles, respectively. The lead compound was 14 with a high selectivity index (SI < 500). Compound 13 showed a higher inhibitory effect on the early stage (entry) of ZIKV replication than compound 14, and was less potent than compound 14 at the post-entry stage, consistent with the docking models. Compounds 13 and 14 also had a strong interaction with the active site pocket of NS5 MTase. Compounds 13 and 14 are recommended for expanded antiviral studies against ZIKV infection.
Zika 病毒(ZIKV)是一种通过蚊子 Aedes spp 传播的新的致病性黄病毒。ZIKV 感染伴随着严重的神经并发症,对孕妇尤其危险,可导致胎儿先天畸形和新生儿小头症。目前,尚无针对 ZIKV 感染的许可疫苗或特定的感染后治疗方法。本报告致力于研究甘草酸(GL)衍生物作为 ZIKV 抑制剂。在三种不同的人细胞系中,对 ZIKV 致细胞病变效应(CPE)和病毒感染力的抑制试验表明,GL 与氨基酸及其酯(甲基、乙基)的缀合受化合物抗病毒活性的影响。GL 缀合物与 GLu(OMe)-OMe 11、Glu(OH)-OMe 12、Asp(OMe)-OMe 13、TyrOMe 14、LeuOEt 15 和 PheOEt 16 具有三萜部分中游离 COOH 基团,对 ZIKV 具有活性。最活跃的化合物 13 和 14 对低剂量(MOI = 0.05)的 ZIKV 株 PRVABC59 的 IC50 值分别为 0.23 μM 和 0.09 μM,对高剂量(MOI = 10)的 ZIKV 株 Natal RGN 单轮感染性颗粒的 IC50 值分别为 1.20 μM 和 0.74 μM。先导化合物 14 的选择性指数(SI < 500)较高。化合物 13 对 ZIKV 复制的早期(进入)阶段的抑制作用强于化合物 14,而在进入后阶段的作用弱于化合物 14,与对接模型一致。化合物 13 和 14 与 NS5 MTase 的活性位点口袋也具有很强的相互作用。化合物 13 和 14 强烈推荐用于针对 ZIKV 感染的扩展抗病毒研究。