HTS, Discovery Sciences, Bio Pharmaceuticals R&D, AstraZeneca, Macclesfield, Cheshire, UK.
Division of Cell Biology, MRC Laboratory of Molecular Biology, Cambridge, Cambridgeshire, UK.
SLAS Discov. 2020 Oct;25(9):985-999. doi: 10.1177/2472555220920581. Epub 2020 May 21.
Cytoplasmic dynein-1 (hereafter dynein) is a six-subunit motor complex that transports a variety of cellular components and pathogens along microtubules. Dynein's cellular functions are only partially understood, and potent and specific small-molecule inhibitors and activators of this motor would be valuable for addressing this issue. It has also been hypothesized that an inhibitor of dynein-based transport could be used in antiviral or antimitotic therapy, whereas an activator could alleviate age-related neurodegenerative diseases by enhancing microtubule-based transport in axons. Here, we present the first high-throughput screening (HTS) assay capable of identifying both activators and inhibitors of dynein-based transport. This project is also the first collaborative screening report from the Medical Research Council and AstraZeneca agreement to form the UK Centre for Lead Discovery. A cellular imaging assay was used, involving chemically controlled recruitment of activated dynein complexes to peroxisomes. Such a system has the potential to identify molecules that affect multiple aspects of dynein biology in vivo. Following optimization of key parameters, the assay was developed in a 384-well format with semiautomated liquid handling and image acquisition. Testing of more than 500,000 compounds identified both inhibitors and activators of dynein-based transport in multiple chemical series. Additional analysis indicated that many of the identified compounds do not affect the integrity of the microtubule cytoskeleton and are therefore candidates to directly target the transport machinery.
细胞质动力蛋白-1(以下简称动力蛋白)是一个由六个亚基组成的马达复合物,它沿着微管运输各种细胞成分和病原体。动力蛋白的细胞功能尚未完全了解,针对该马达的有效且特异性的小分子抑制剂和激活剂将具有重要价值。人们还假设,基于动力蛋白的运输抑制剂可用于抗病毒或抗有丝分裂治疗,而激活剂可通过增强轴突中的微管基于运输来缓解与年龄相关的神经退行性疾病。在这里,我们提出了第一个能够识别基于动力蛋白的运输的激活剂和抑制剂的高通量筛选(HTS)测定法。该项目也是英国研究理事会(MRC)和阿斯利康(AstraZeneca)之间的首个合作筛选报告,旨在建立英国先导化合物发现中心。使用细胞成像测定法,涉及化学控制募集激活的动力蛋白复合物到过氧化物酶体。这样的系统有可能识别出影响体内动力蛋白生物学多个方面的分子。在优化关键参数后,该测定法以半自动化的液体处理和图像采集形式在 384 孔格式中进行开发。对超过 500,000 种化合物的测试鉴定了多种化学系列中基于动力蛋白的运输的抑制剂和激活剂。进一步的分析表明,许多鉴定出的化合物不影响微管细胞骨架的完整性,因此是直接靶向运输机制的候选药物。