The Donnelly Centre, University of Toronto, Toronto, Ontario, Canada.
PLoS Negl Trop Dis. 2021 Nov 29;15(11):e0009991. doi: 10.1371/journal.pntd.0009991. eCollection 2021 Nov.
Soil transmitted helminths (STHs) are major human pathogens that infect over a billion people. Resistance to current anthelmintics is rising and new drugs are needed. Here we combine multiple approaches to find druggable targets in the anaerobic metabolic pathways STHs need to survive in their mammalian host. These require rhodoquinone (RQ), an electron carrier used by STHs and not their hosts. We identified 25 genes predicted to act in RQ-dependent metabolism including sensing hypoxia and RQ synthesis and found 9 are required. Since all 9 have mammalian orthologues, we used comparative genomics and structural modeling to identify those with active sites that differ between host and parasite. Together, we found 4 genes that are required for RQ-dependent metabolism and have different active sites. Finding these high confidence targets can open up in silico screens to identify species selective inhibitors of these enzymes as new anthelmintics.
土壤传播的蠕虫(STHs)是主要的人类病原体,感染了超过 10 亿人。目前抗寄生虫药物的耐药性正在上升,需要新的药物。在这里,我们结合多种方法来寻找在 STH 赖以生存的厌氧代谢途径中可成药的靶标。这些途径需要 rhodoquinone(RQ),这是 STH 而非其宿主使用的电子载体。我们鉴定了 25 个预测在 RQ 依赖性代谢中起作用的基因,包括对缺氧和 RQ 合成的感应,发现其中 9 个是必需的。由于所有 9 个都有哺乳动物同源物,我们使用比较基因组学和结构建模来鉴定那些在宿主和寄生虫之间具有不同活性位点的基因。总的来说,我们发现了 4 个依赖 RQ 代谢的基因,它们具有不同的活性位点。找到这些高置信度的靶标可以通过计算机筛选来识别对这些酶具有种属选择性的抑制剂,作为新的驱虫药。