Institut für Pharmazie (Pharmakologie und Toxikologie) der Freien Universität Berlin, Berlin, Deutschland.
Skin Pharmacol Physiol. 2010;23(1):6-14. doi: 10.1159/000257258. Epub 2010 Jan 14.
Actinic keratosis and cutaneous squamous cell carcinoma are of increasing importance with aging and increased ultraviolet light exposure in Western societies. Efficient and well-tolerated therapy is still a matter of concern. As with tumours of other organs, new target sites and innovative drugs selectively addressing them are widely looked for. Due to the relevance for DNA synthesis and thus cell proliferation, human DNA polymerase alpha should be such a target, the more so as the three-dimensional structure of the active site has been proposed based on the application of molecular modelling methods and molecular dynamics simulations. The modelled structure of the active site was used for docking nucleotide analogues in order to design selective inhibitors. Consequently, well-fitting thymidine and guanosine analogues were synthesized and tested in vitro for their influence on normal and transformed human keratinocytes. In fact, the combination of modelling studies and in vitro tests allowed us to design antiproliferative and cytotoxic agents which are new drug candidates for the therapy of skin tumours, given the agents are no relevant substrates of nucleotide transporters (MRP-4, MRP-5) expressed by skin cancer cells. Essential kinases for nucleoside activation were detected, too, corresponding with the observed effects of nucleoside analogues. Due to the rather high molecular weight and poor solubility, however, skin penetration should be poor and thus topical therapy may require carriers to improve the uptake. This becomes feasible by lipidic and non-lipidic nanoparticles which can enhance the uptake of lipophilic agents up to 13-fold.
光化性角化病和皮肤鳞状细胞癌在西方社会随着年龄的增长和紫外线照射的增加变得越来越重要。高效且耐受性良好的治疗方法仍然是人们关注的焦点。与其他器官的肿瘤一样,人们广泛寻找新的靶点和创新药物来有针对性地治疗这些疾病。由于人类 DNA 聚合酶 alpha 与 DNA 合成有关,进而与细胞增殖有关,因此它应该成为一个潜在的治疗靶点,特别是由于其活性位点的三维结构已经基于分子建模方法和分子动力学模拟的应用而被提出。该活性位点模型被用于核苷酸类似物的对接,以设计选择性抑制剂。因此,合成了与胸腺嘧啶和鸟嘌呤适配良好的类似物,并在体外测试它们对正常和转化的人角质形成细胞的影响。事实上,通过建模研究和体外测试相结合,我们设计出了具有抗增殖和细胞毒性的药物,这些药物是治疗皮肤肿瘤的新候选药物,因为这些药物不是皮肤癌细胞表达的核苷酸转运体(MRP-4、MRP-5)的相关底物。还检测到了核苷激活所需的关键激酶,这与核苷类似物的观察效果相对应。然而,由于分子量相当大且水溶性差,皮肤渗透可能较差,因此局部治疗可能需要载体来提高药物的摄取。这可以通过脂质和非脂质纳米颗粒来实现,这些颗粒可以将亲脂性药物的摄取量提高 13 倍。