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Research Articles

In vitro Leishmanicidal evaluation and molecular docking simulations of bioactive compounds from the bark of Taxus wallichiana

, , ORCID Icon, , , , & ORCID Icon show all
Pages 473-478 | Received 23 Jul 2023, Accepted 19 Feb 2024, Published online: 14 Mar 2024

References

  • Arfan M, Amin H, Khan I, Shah MR, Shah H, Khan AZ, Halimi SMA, Khan N, Kaleem WA, Qayum M, et al. 2012. Molecular simulations of bergenin as a new urease inhibitor. Med Chem Res. 21(9):2454–2457. doi:10.1007/s00044-011-9762-6.
  • Banerjee S, Upadhyay N, Kukreja A, Ahuja P, Kumar S, Saha G, Sharma R, Chattopadhyay S. 1996. Taxanes from in vitro cultures of the Himalayan yew Taxus wallichiana. Planta Med. 62(4):329–331. doi:10.1055/s-2006-957895.
  • Barboni L, Gariboldi P, Torregiani E, Appendino G, Gabetta B, Zini G, Bombardelli E. 1993. Taxanes from the needles of Taxus wallichiana. Phytochemistry. 33(1):145–150. doi:10.1016/0031-9422(93)85411-J.
  • Berman H, Henrick K, Nakamura H. 2003. Announcing the worldwide protein data bank. Nat Struct Biol. 10(12):980–980. doi:10.1038/nsb1203-980.
  • Chang MW, Ayeni C, Breuer S, Torbett BE. 2010. Virtual screening for HIV protease inhibitors: a comparison of AutoDock 4 and Vina. PLoS One. 5(8):e11955. doi:10.1371/journal.pone.0011955.
  • Dumas C, Ouellette M, Tovar J, Cunningham ML, Fairlamb AH, Tamar S, Olivier M, Papadopoulou B. 1997. Disruption of the trypanothione reductase gene of Leishmania decreases its ability to survive oxidative stress in macrophages. Embo J. 16(10):2590–2598. doi:10.1093/emboj/16.10.2590.
  • Garcia MCF, Soares DC, Santana RC, Saraiva EM, Siani AC, Ramos MFS, Danelli M, Souto-Padron TC, Pinto-da-Silva LH. 2018. The in vitro antileishmanial activity of essential oil from Aloysia gratissima and guaiol, its major sesquiterpene against Leishmania amazonensis. Parasitology. 145(9):1219–1227. doi:10.1017/S0031182017002335.
  • Ghadimi SN, Sharifi N, Osanloo M. 2020. The leishmanicidal activity of essential oils: a systematic review. J Herbmed Pharmacol. 9(4):300–308. doi:10.34172/jhp.2020.38.
  • Guex N, Peitsch MC. 1997. SWISS‐MODEL and the Swiss‐Pdb Viewer: an environment for comparative protein modeling. Electrophoresis. 18(15):2714–2723. doi:10.1002/elps.1150181505.
  • Gundampati RK, Jagannadham MV. 2012. Molecular docking based inhibition of trypanothione reductase activity by taxifolin novel target for antileishmanial activity. J App Pharm Sci. 2(2), 14. doi:10.7324/JAPS.2012.21026.
  • Hanwell MD, Curtis DE, Lonie DC, Vandermeersch T, Zurek E, Hutchison GR. 2012. Avogadro: an advanced semantic chemical editor, visualization, and analysis platform. J Cheminform. 4(1):17. doi:10.1186/1758-2946-4-17.
  • Jacob RB, Andersen T, McDougal OM. 2012. Accessible high-throughput virtual screening molecular docking software for students and educators. PLoS Comput Biol. 8(5):e1002499. doi:10.1371/journal.pcbi.1002499.
  • Juyal D, Thawani V, Thaledi S, Joshi M. 2014. Ethnomedical properties of Taxus wallichiana Zucc. (Himalayan yew). J Tradit Complement Med. 4(3):159–161. doi:10.4103/2225-4110.136544.
  • Khan, Inamullah, Nisar, Muhammad, Shah, Muhammad Raza, Shah, Hamidullah, Gilani, Syed Naeemuddin, Gul, Farah, Abdullah, Syed Muhammad, Ismail, Mohammad, Khan, Nematullah, Kaleem, Waqar Ahmad, Qayum, Mughal,. 2011. Anti-inflammatory activities of Taxusabietane A isolated from Taxus wallichiana Zucc. Fitoterapia. 82(7):1003–1007. doi:10.1016/j.fitote.2011.06.003.
  • Kumar A, Kumar S, Jain S, Kumar P, Goyal R. 2013. Study of binding of pyridoacridine alkaloids on topoisomerase II using in silico tools. Med Chem Res. 22(11):5431–5441. doi:10.1007/s00044-013-0496-5.
  • Li Z, Wan H, Shi Y, Ouyang P. 2004. Personal experience with four kinds of chemical structure drawing software: review on ChemDraw, ChemWindow, ISIS/Draw, and ChemSketch. J Chem Inf Comput Sci. 44(5):1886–1890. doi:10.1021/ci049794h.
  • Miller RW, Powell RG, Smith CR, Jr, Arnold E, Clardy J. 1981. Antileukemic alkaloids from Taxus wallichiana Zucc. J Org Chem. 46(7):1469–1474. doi:10.1021/jo00320a045.
  • Monzote L, Nance MR, García M, Scull R, Setzer WN. 2011. Comparative chemical, cytotoxicity and antileishmanial properties of essential oils from Chenopodium ambrosioides. Nat Prod Commun. 6(2):1934578X1100600. 1934578X1100600232. doi:10.1177/1934578X1100600232.
  • Navia-Osorio A, Garden H, Cusidó RM, Palazón J, Alfermann AW, Piñol MT. 2002. Taxol® and baccatin III production in suspension cultures of Taxus baccata and Taxus wallichiana in an airlift bioreactor. J Plant Physiol. 159(1):97–102. doi:10.1078/0176-1617-00576.
  • Nisar, Muhammad, Khan, Inamullah, Simjee, Shabana Usman, Gilani, Anwarul Hasan, Perveen, Humera Obaidullah, 2008. Anticonvulsant, analgesic and antipyretic activities of Taxus wallichiana Zucc. J Ethnopharmacol. 116(3):490–494. doi:10.1016/j.jep.2007.12.021.
  • Nisar M, Qayum M, Adhikari A, Khan I, Kaleem WA, Ali Z, Choudhary MI. 2010. 4-Deacetylbaccatin III: a proposed biosynthetic precursor of paclitaxel from the bark of Taxus wallichiana. Nat Prod Commun. 5(11):1934578X1000501. doi:10.1177/1934578X1000501104.
  • Ondari ME, Walker KD. 2008. The taxol pathway 10-O-acetyltransferase shows regioselective promiscuity with the oxetane hydroxyl of 4-deacetyltaxanes. J Am Chem Soc. 130(50):17187–17194. doi:10.1021/ja8067534.
  • Onocha P, Ali M. 2010. Antileishmaniasis, phytotoxicity and cytotoxicity of Nigerian Euphorbiaceous Plants 2: Phyllanthus amarus and Phyllanthus muellerianus Extracts. Afr Sci. 11(2):79–83.
  • Peitsch MC, Schwede T, Guex N. 2000. Automated protein modelling-the proteome in 3D. Pharmacogenomics. 1(3):257–266. doi:10.1517/14622416.1.3.257.
  • Phillipson JD. 2001. Phytochemistry and medicinal plants. Phytochemistry. 56(3):237–243. doi:10.1016/s0031-9422(00)00456-8.
  • Rauf A, Khan R, Raza M, Khan H, Pervez S, De Feo V, Maione F, Mascolo N. 2015. Suppression of inflammatory response by chrysin, a flavone isolated from Potentilla evestita Th. Wolf. In silico predictive study on its mechanistic effect. Fitoterapia. 103:129–135. doi:10.1016/j.fitote.2015.03.019.
  • Rauf A, Saleem M, Uddin G, Siddiqui BS, Khan H, Raza M, Hamid SZ, Khan A, Maione F, Mascolo N, et al. 2015. Phosphodiesterase-1 inhibitory activity of two flavonoids isolated from Pistacia integerrima JL stewart galls. Evid Base Complem Alter Med. 2015:1–6. doi:10.1155/2015/506564.
  • Rauf A, Uddin G, Khan H, Raza M, Zafar M, Tokuda H. 2016. Anti-tumour-promoting and thermal-induced protein denaturation inhibitory activities of β-sitosterol and lupeol isolated from Diospyros lotus L. Nat Prod Res. 30(10):1205–1207. doi:10.1080/14786419.2015.1046381.
  • Salem MM, Werbovetz KA. 2006. Natural products from plants as drug candidates and lead compounds against Leishmaniasis and trypanosomiasis. Curr Med Chem. 13(21):2571–2598. doi:10.2174/092986706778201611.
  • Santos A, Santin A, Yamaguchi M, Cortez L, Ueda-Nakamura T, Dias-Filho B, Nakamura C. 2010. Antileishmanial activity of an essential oil from the leaves and flowers of Achillea millefolium. Ann Trop Med Parasitol. 104(6):475–483. doi:10.1179/136485910X12786389891281.
  • Shen Y-C, Chang Y-T, Wang S-S, Pan Y-L, Lo K-L, Lin Y-C. 2003. Novel taxane diterpenoids from Taiwanese yew trees. Toxin Review. 22(4):533–545.
  • Shukla AK, Singh BK, Patra S, Dubey VK. 2010. Rational approaches for drug designing against Leishmaniasis. Appl Biochem Biotechnol. 160(8):2208–2218. doi:10.1007/s12010-009-8764-z.
  • Tamargo B, Monzote L, Piñón A, Machín L, García M, Scull R, Setzer WN. 2017. In vitro and in vivo evaluation of essential oil from Artemisia absinthium L. formulated in nanocochleates against cutaneous Leishmaniasis. Medicines. 4(2):38. doi:10.3390/medicines4020038.
  • Tovar J, Cunningham ML, Smith AC, Croft SL, Fairlamb AH. 1998. Down-regulation of Leishmania donovani trypanothione reductase by heterologous expression of a trans-dominant mutant homologue: effect on parasite intracellular survival. Proc Natl Acad Sci USA. 95(9):5311–5316. doi:10.1073/pnas.95.9.5311.
  • Trott O, Olson AJ. 2010. AutoDock Vina: improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading. J Comput Chem. 31(2):455–461. doi:10.1002/jcc.21334.
  • Verma RK, Prajapati VK, Verma GK, Chakraborty D, Sundar S, Rai M, Dubey VK, Singh MS. 2012. Molecular docking and in vitro antileishmanial evaluation of chromene-2-thione analogues. ACS Med Chem Lett. 3(3):243–247. doi:10.1021/ml200280r.
  • Yellamma K, Nagaraju S, Peera K, Praveen K. 2013. To design novel lead molecules for the enzyme, AChE associated with Alzheimer’s disease. Int J Pharmaceut Sci Rev Res. 22(2):296–302.

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