Fischer Igor, Nickel Ann-Christin, Qin Nan, Taban Kübra, Pauck David, Steiger Hans-Jakob, Kamp Marcel, Muhammad Sajjad, Hänggi Daniel, Fritsche Ellen, Remke Marc, Kahlert Ulf Dietrich
Clinic for Neurosurgery, Medical Faculty, Heinrich-Heine University Düsseldorf, 40225 Düsseldorf, Germany.
Department of Pediatric Oncology, Hematology, and Clinical Immunology, Medical Faculty, University Hospital Düsseldorf, 40225 Düsseldorf, Germany.
Cells. 2020 Dec 15;9(12):2689. doi: 10.3390/cells9122689.
In cancer pharmacology, a drug candidate's therapeutic potential is typically expressed as its ability to suppress cell growth. Different methods in assessing the cell phenotype and calculating the drug effect have been established. However, inconsistencies in drug response outcomes have been reported, and it is still unclear whether and to what extent the choice of data post-processing methods is responsible for that. Studies that systematically examine these questions are rare. Here, we compare three established calculation methods on a collection of nine in vitro models of glioblastoma, exposed to a library of 231 clinical drugs. The therapeutic potential of the drugs is determined on the growth curves, using growth inhibition 50% (GI50) and point-of-departure (PoD) as the criteria. An effect is detected on 36% of the drugs when relying on GI50 and on 27% when using PoD. For the area under the curve (AUC), a threshold of 9.5 or 10 could be set to discriminate between the drugs with and without an effect. GI50, PoD, and AUC are highly correlated. The ranking of substances by different criteria varies somewhat, but the group of the top 20 substances according to one criterion typically includes 17-19 top candidates according to another. In addition to generating preclinical values with high clinical potential, we present off-target appreciation of top substance predictions by interrogating the drug response data of non-cancer cells in our calculation technology.
在癌症药理学中,候选药物的治疗潜力通常以其抑制细胞生长的能力来表示。已经建立了评估细胞表型和计算药物效果的不同方法。然而,已有报道称药物反应结果存在不一致性,而且数据后处理方法的选择是否以及在何种程度上导致了这种情况仍不清楚。系统研究这些问题的研究很少。在这里,我们在9个胶质母细胞瘤体外模型的集合上比较了三种既定的计算方法,这些模型暴露于一个包含231种临床药物的文库中。以生长抑制50%(GI50)和起始点(PoD)为标准,根据生长曲线确定药物的治疗潜力。依靠GI50时,检测到36%的药物有效果;使用PoD时,检测到27%的药物有效果。对于曲线下面积(AUC),可以设置9.5或10的阈值来区分有效果和无效果的药物。GI50、PoD和AUC高度相关。不同标准对物质的排名略有不同,但根据一种标准排名前20的物质组通常包括根据另一种标准排名前17 - 19的顶级候选物质。除了生成具有高临床潜力的临床前值外,我们还通过在计算技术中询问非癌细胞的药物反应数据,对顶级物质预测进行脱靶评估。