IEEE/ACM Trans Comput Biol Bioinform. 2021 Jul-Aug;18(4):1271-1280. doi: 10.1109/TCBB.2021.3075299. Epub 2021 Aug 6.
COVID-19 is a highly contagious disease caused by the severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2). The case-fatality rate is significantly higher in older patients and those with diabetes, cancer or cardiovascular disorders. The human proteins, angiotensin-converting enzyme 2 (ACE2), transmembrane protease serine 2 (TMPRSS2) and basigin (BSG), are involved in high-confidence host-pathogen interactions with SARS-CoV-2 proteins. We considered these three proteins as seed nodes and applied the random walk with restart method on the human interactome to construct a protein-protein interaction sub-network, which captures the effects of viral invasion. We found that 'Insulin resistance', 'AGE-RAGE signaling in diabetic complications' and 'adipocytokine signaling' were the common pathways associated with diabetes, cancer and cardiovascular disorders. The association of these critical pathways with aging and its related diseases explains the molecular basis of COVID-19 fatality. We further identified drugs that have effects on these proteins/pathways based on gene expression studies. We particularly focused on drugs that significantly downregulate ACE2 along with other critical proteins identified by the network-based approach. Among them, COL-3 had earlier shown activity against acute lung injury and acute respiratory distress, while entinostat and mocetinostat have been investigated for non-small-cell lung cancer. We propose that these drugs can be repurposed for COVID-19.
新型冠状病毒肺炎(COVID-19)是一种由严重急性呼吸综合征冠状病毒 2(SARS-CoV-2)引起的高传染性疾病。在老年患者和患有糖尿病、癌症或心血管疾病的患者中,病死率显著更高。人类蛋白血管紧张素转化酶 2(ACE2)、跨膜丝氨酸蛋白酶 2(TMPRSS2)和基底蛋白(BSG)参与了与 SARS-CoV-2 蛋白的高可信度宿主-病原体相互作用。我们将这三种蛋白视为种子节点,并在人类相互作用组上应用随机游走带重启方法构建蛋白-蛋白相互作用子网络,以捕捉病毒入侵的影响。我们发现“胰岛素抵抗”、“糖尿病并发症中的 AGE-RAGE 信号”和“脂肪细胞因子信号”是与糖尿病、癌症和心血管疾病相关的共同途径。这些关键途径与衰老及其相关疾病的关联解释了 COVID-19 致死的分子基础。我们进一步根据基因表达研究确定了对这些蛋白/途径有影响的药物。我们特别关注那些通过网络方法确定的能显著下调 ACE2 及其他关键蛋白的药物。其中,COL-3 早期已显示出对急性肺损伤和急性呼吸窘迫的活性,而恩替诺特和莫西替诺特已被用于非小细胞肺癌的研究。我们提出这些药物可以被重新用于 COVID-19。