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. 2015 Aug 4;9:4259–4268. doi: 10.2147/DDDT.S89976

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© 2015 Yun et al. This work is published by Dove Medical Press Limited, and licensed under Creative Commons Attribution – Non Commercial (unported, v3.0) License

The full terms of the License are available at http://creativecommons.org/licenses/by-nc/3.0/. Non-commercial uses of the work are permitted without any further permission from Dove Medical Press Limited, provided the work is properly attributed.

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Docking simulation between tyrosinase and BPA13 or kojic acid.

Notes: (A) Docking simulation between mushroom tyrosinase and BPA13 shown in magenta. (B) The pharmacophore model generated using the LigandScout 3.1 program indicated possible hydrogen bonding interactions and hydrophobic interactions between tyrosinase residues and BPA13. (C) Docking simulation between tyrosinase and kojic acid, used as a positive control. (D) The pharmacophore model generated using the LigandScout 3.1 program indicated a possible hydrogen bonding interaction between tyrosinase residues and kojic acid.

Abbreviation: BPA, (E)-2-benzoyl-3-(substituted phenyl)acrylonitrile.