Barbero Ana M, Frasch H Frederick
Health Effects Laboratory Division, National Institute for Occupational Safety and Health, 1095 Willowdale Road, Morgantown, WV 26505, USA.
Health Effects Laboratory Division, National Institute for Occupational Safety and Health, 1095 Willowdale Road, Morgantown, WV 26505, USA.
J Control Release. 2017 Aug 28;260:234-246. doi: 10.1016/j.jconrel.2017.05.034. Epub 2017 Jun 29.
The impact of the complex structure of the stratum corneum on transdermal penetration is not yet fully described by existing models. A quantitative and thorough study of skin permeation is essential for chemical exposure assessment and transdermal delivery of drugs. The objective of this study is to analyze the effects of heterogeneity, anisotropy, asymmetry, follicular diffusion, and location of the main barrier of diffusion on percutaneous permeation. In the current study, the solution of the transient diffusion through a two-dimensional-anisotropic brick-and-mortar geometry of the stratum corneum is obtained using the commercial finite element program COMSOL Multiphysics. First, analytical solutions of an equivalent multilayer geometry are used to determine whether the lipids or corneocytes constitute the main permeation barrier. Also these analytical solutions are applied for validations of the finite element solutions. Three illustrative compounds are analyzed in these sections: diethyl phthalate, caffeine and nicotine. Then, asymmetry with depth and follicular diffusion are studied using caffeine as an illustrative compound. The following findings are drawn from this study: the main permeation barrier is located in the lipid layers; the flux and lag time of diffusion through a brick-and-mortar geometry are almost identical to the values corresponding to a multilayer geometry; the flux and lag time are affected when the lipid transbilayer diffusivity or the partition coefficients vary with depth, but are not affected by depth-dependent corneocyte diffusivity; and the follicular contribution has significance for low transbilayer lipid diffusivity, especially when flux between the follicle and the surrounding stratum corneum is involved. This study demonstrates that the diffusion is primarily transcellular and the main barrier is located in the lipid layers.
角质层的复杂结构对透皮渗透的影响尚未被现有模型完全描述。对皮肤渗透进行定量和全面的研究对于化学暴露评估和药物透皮给药至关重要。本研究的目的是分析异质性、各向异性、不对称性、毛囊扩散以及扩散主要屏障的位置对经皮渗透的影响。在当前研究中,使用商业有限元程序COMSOL Multiphysics获得了通过角质层二维各向异性砖石结构的瞬态扩散解。首先,使用等效多层结构的解析解来确定脂质或角质形成细胞是否构成主要渗透屏障。这些解析解也用于验证有限元解。在这些部分中分析了三种示例性化合物:邻苯二甲酸二乙酯、咖啡因和尼古丁。然后,以咖啡因作为示例性化合物研究了深度不对称性和毛囊扩散。本研究得出以下结果:主要渗透屏障位于脂质层;通过砖石结构的扩散通量和滞后时间几乎与对应多层结构的值相同;当脂质跨膜扩散率或分配系数随深度变化时,通量和滞后时间会受到影响,但不受深度依赖性角质形成细胞扩散率的影响;并且毛囊贡献对于低跨膜脂质扩散率具有重要意义,特别是当涉及毛囊与周围角质层之间的通量时。本研究表明,扩散主要是跨细胞的,主要屏障位于脂质层。