Molecular docking of viscosine as a new lipoxygenase inhibitor isolated from <i>Dodonaea viscosa</i>

Authors

  • Amir Zada Khan Department of Pharmacy, University of Peshawar, Peshawar 25120
  • Akhtar Mohammad Department of Chemistry, University of Karachi, Karachi 75270
  • Zafar Iqbal Department of Pharmacy, University of Peshawar, Peshawar 25120
  • Itrat Anis Department of Chemistry, University of Karachi, Karachi 75270
  • Muhammad Raza Shah H. E. J. Research Institute of Chemistry, International Center for Chemical and Biological Sciences, University of Karachi, Karachi 75270
  • Said Nadeem H. E. J. Research Institute of Chemistry, International Center for Chemical and Biological Sciences, University of Karachi, Karachi 75270
  • Muhammad Rabnawaz H. E. J. Research Institute of Chemistry, International Center for Chemical and Biological Sciences, University of Karachi, Karachi 75270
  • Adnan Shahidullah Department of Pharmacy, University of Peshawar, Peshawar 25120
  • Humayun Khan Department of Pharmacy, University of Peshawar, Peshawar 25120
  • Inamullah Khan Department of Pharmacy, University of Peshawar, Peshawar 25120

DOI:

https://doi.org/10.3329/bjp.v8i1.13088

Keywords:

Dodonaea viscosa, Lipoxygenase, Molecular docking

Abstract

Viscosine was isolated from Dodonaea viscosa, which showed significant lipoxygenase inhibitory activity (IC50: value 39 ± 0.17). Molecular docking simulations were conducted to explore molecular binding mode, and to help elucidate molecular mechanism behind its significant inhibitory activity. Molecular interactions of viscosine with catalytic triad (His523, His518, Ile875) inside active site of lipoxygenase via hydrogen bonding, seems to be the major factor involved in its significant lipoxygenase inhibitory activity.

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References

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Khan I, Nisar M, Shah MR, Shah H, Gilani SN, Gul F, Abdullah SM, Ismail M, Khan N, Kaleem WA, Qayum M, Khan HO. Anti-inflammatory activities of Taxusabietane A isolated from Taxus wallichiana Zucc. Fitoterapea. 2011; 82: 1003-07.

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Published

2012-12-30

How to Cite

Khan, A. Z., A. Mohammad, Z. Iqbal, I. Anis, M. R. Shah, S. Nadeem, M. Rabnawaz, A. Shahidullah, H. Khan, and I. Khan. “/I>”;. Bangladesh Journal of Pharmacology, vol. 8, no. 1, Dec. 2012, pp. 36-39, doi:10.3329/bjp.v8i1.13088.

Issue

Vol. 8 No. 1 (2013)

Section

Research Articles

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