子宫颈癌候选药物红曲霉色素衍生物毒性参数的硅片研究

Lina Rahmawati Rizkuloh, A. Pratita, Mediana Mediana, A. Yuliana
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引用次数: 2

摘要

毒性预测对于新药的开发和设计非常重要,因为计算毒性估计不仅比确定动物毒性剂量更快,而且还有助于减少动物试验的次数。测试使用pkCSM, Protox II, Toxtree, preADMET和T.E.S.T.。从对红曲霉霉菌的57种色素衍生化合物进行的研究结果来看,pkCSM应用的结果是39种测试化合物,Protox-II应用产生1种化合物,Toxtree应用产生1种化合物,preADMET应用产生4种安全化合物。并为T.E.S.T申请生产1种化合物,因为它满足ICH(国际协调会议)S9的一个方面:2010年抗癌药物的非临床评价,并有潜力作为抗癌药物的候选药物。
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In silico study in toxicity parameters of Pigment Derivated Compounds of Monascus sp. mold as a cervical anti-cancer drugs candidate
Toxicity prediction is very important for the development and design of new drugs because computational toxicity estimates are not only faster than the determination of toxic doses in animals, but can also help reduce the number of animal trials. The test uses pkCSM, Protox II, Toxtree, preADMET and T.E.S.T. From the results of research that has been carried out on 57 pigment derivated compounds of Monascus sp. mold, the results of the pkCSM application are 39 test compounds for the Protox-II application there is 1 compound, the Toxtree application produces 1 compound, for the PreADMET application 4 safe compounds are produced, and for the T.E.S.T application produces 1 compound because it fulfills one of the aspects of ICH (International Conference on Harmonization) S9: non-clinical evaluation for anticancer pharmaceutical 2010 and has the potential as a candidate for anticancer drugs. .
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