Ndjomou Jean, Corby M Josie, Sweeney Noreena L, Hanson Alicia M, Aydin Cihan, Ali Akbar, Schiffer Celia A, Li Kelin, Frankowski Kevin J, Schoenen Frank J, Frick David N
‡Department of Biochemistry and Molecular Pharmacology, University of Massachusetts Medical School, Worcester, Massachusetts 01605, United States.
§University of Kansas Specialized Chemistry Center, University of Kansas, 2034 Becker Drive, Lawrence, Kansas 66047, United States.
ACS Chem Biol. 2015 Aug 21;10(8):1887-96. doi: 10.1021/acschembio.5b00101. Epub 2015 May 22.
This study examines the specificity and mechanism of action of a recently reported hepatitis C virus (HCV) nonstructural protein 3 (NS3) helicase-protease inhibitor (HPI), and the interaction of HPI with the NS3 protease inhibitors telaprevir, boceprevir, danoprevir, and grazoprevir. HPI most effectively reduced cellular levels of subgenomic genotype 4a replicons, followed by genotypes 3a and 1b replicons. HPI had no effect on HCV genotype 2a or dengue virus replicon levels. Resistance evolved more slowly to HPI than telaprevir, and HPI inhibited telaprevir-resistant replicons. Molecular modeling and analysis of the ability of HPI to inhibit peptide hydrolysis catalyzed by a variety of wildtype and mutant NS3 proteins suggested that HPI forms a bridge between the NS3 RNA-binding cleft and an allosteric site previously shown to bind other protease inhibitors. In most combinations, the antiviral effect of HPI was additive with telaprevir and boceprevir, minor synergy was observed with danoprevir, and modest synergy was observed with grazoprevir.
本研究考察了一种最近报道的丙型肝炎病毒(HCV)非结构蛋白3(NS3)解旋酶-蛋白酶抑制剂(HPI)的作用特异性和作用机制,以及HPI与NS3蛋白酶抑制剂特拉匹韦、波普瑞韦、达诺普韦和格佐普韦的相互作用。HPI最有效地降低了亚基因组4a型基因型复制子的细胞水平,其次是3a型和1b型基因型复制子。HPI对HCV 2a型基因型或登革病毒复制子水平没有影响。与特拉匹韦相比,对HPI产生耐药性的进化更为缓慢,并且HPI抑制了对特拉匹韦耐药的复制子。分子建模以及对HPI抑制多种野生型和突变型NS3蛋白催化的肽水解能力的分析表明,HPI在NS3 RNA结合裂隙和先前显示可结合其他蛋白酶抑制剂的变构位点之间形成了一座桥梁。在大多数组合中,HPI与特拉匹韦和波普瑞韦的抗病毒作用是相加的,与达诺普韦观察到轻微协同作用,与格佐普韦观察到适度协同作用。