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Metabolic Modeling and Simulation Analysis of Thyroid Disorder Pathway

机译:甲状腺功能障碍通路的代谢建模与仿真分析

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Thyroid hormone secretion pathway is one of the important pathways that regulates growth, development and is considered critical for brain, skeletal development and maturation. Autoimmune Thyroid Disease (AITD) results in damage of the thyroid gland altering the normal secretion of thyroid hormones causing hypothyroidism (Hashimoto’s thyroiditis) or hyperthyroidism (graves’ disease). A map of molecular interaction of the thyroid stimulating hormone receptor has been created using systems biology graphical notation language with the help of CellDesigner 4.1 and converted into BioPax 2.8.2 pathways description format. In the current state the map contains 9 compartment, 32 simple and complex protein, 18 small molecules, 3 ions and 35 chemical reactions. The network contains more details about Thyroid hormones, Thyroxin (T4) and Triiodothyronin (T3), secretion pathway than existing large scale real pathways. Simulation was done in order to understand the time-dependent behavior of TSH, T3 and T4 by taking 16 different cases related thyroid disorder. The simulation patterns are invariable after passing with certain period, it does not deviate the simulation pattern of pathways. This study helps in identification of novel targets related with different types of thyroid disorder. To anticipate potential drug targets by system-wide analysis of the metabolic network for the effective treatment of thyroid disorder, the model can be useful.
机译:甲状腺激素分泌途径是调节生长,发育的重要途径之一,被认为对大脑,骨骼发育和成熟至关重要。自身免疫性甲状腺疾病(AITD)会导致甲状腺功能受损,从而改变甲状腺激素的正常分泌,从而导致甲状腺功能减退症(桥本氏甲状腺炎)或甲状腺功能亢进症(重症)。借助CellDesigner 4.1,使用系统生物学图形符号语言创建了甲状腺刺激激素受体的分子相互作用图,并将其转换为BioPax 2.8.2途径描述格式。在当前状态下,该图包含9个区室,32个简单和复杂蛋白质,18个小分子,3个离子和35个化学反应。与现有的大规模真实途径相比,该网络包含有关甲状腺激素,甲状腺素(T4)和三碘甲状腺素(T3)分泌途径的更多详细信息。进行模拟是为了了解16种与甲状腺疾病相关的病例,从而了解TSH,T3和T4的时间依赖性行为。经过一定时间后,仿真模式不变,不会偏离路径的仿真模式。这项研究有助于确定与不同类型的甲状腺疾病有关的新目标。为了通过有效地治疗甲状腺疾病的代谢网络的全系统分析来预测潜在的药物靶标,该模型可能会有用。

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