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Computer-aided discovery, validation, and mechanistic characterization of novel neolignan activators of peroxisome proliferator-activated receptor gamma.
Fakhrudin N, Ladurner A, Atanasov AG, Heiss EH, Baumgartner L, Markt P, Schuster D, Ellmerer EP, Wolber G, Rollinger JM, Stuppner H, Dirsch VM. Fakhrudin N, et al. Among authors: stuppner h. Mol Pharmacol. 2010 Apr;77(4):559-66. doi: 10.1124/mol.109.062141. Epub 2010 Jan 11. Mol Pharmacol. 2010. PMID: 20064974 Free PMC article.
11beta-Hydroxysteroid dehydrogenase 1 inhibiting constituents from Eriobotrya japonica revealed by bioactivity-guided isolation and computational approaches.
Rollinger JM, Kratschmar DV, Schuster D, Pfisterer PH, Gumy C, Aubry EM, Brandstötter S, Stuppner H, Wolber G, Odermatt A. Rollinger JM, et al. Among authors: stuppner h. Bioorg Med Chem. 2010 Feb 15;18(4):1507-15. doi: 10.1016/j.bmc.2010.01.010. Epub 2010 Jan 11. Bioorg Med Chem. 2010. PMID: 20100662
Applications of integrated data mining methods to exploring natural product space for acetylcholinesterase inhibitors.
Schuster D, Kern L, Hristozov DP, Terfloth L, Bienfait B, Laggner C, Kirchmair J, Grienke U, Wolber G, Langer T, Stuppner H, Gasteiger J, Rollinger JM. Schuster D, et al. Among authors: stuppner h. Comb Chem High Throughput Screen. 2010 Jan;13(1):54-66. doi: 10.2174/138620710790218212. Comb Chem High Throughput Screen. 2010. PMID: 20214575 Free PMC article.
Predicting cyclooxygenase inhibition by three-dimensional pharmacophoric profiling. Part II: Identification of enzyme inhibitors from Prasaplai, a Thai traditional medicine.
Waltenberger B, Schuster D, Paramapojn S, Gritsanapan W, Wolber G, Rollinger JM, Stuppner H. Waltenberger B, et al. Among authors: stuppner h. Phytomedicine. 2011 Jan 15;18(2-3):119-33. doi: 10.1016/j.phymed.2010.08.002. Epub 2010 Sep 20. Phytomedicine. 2011. PMID: 20851587 Free PMC article.
Discovery of a novel IKK-β inhibitor by ligand-based virtual screening techniques.
Noha SM, Atanasov AG, Schuster D, Markt P, Fakhrudin N, Heiss EH, Schrammel O, Rollinger JM, Stuppner H, Dirsch VM, Wolber G. Noha SM, et al. Among authors: stuppner h. Bioorg Med Chem Lett. 2011 Jan 1;21(1):577-83. doi: 10.1016/j.bmcl.2010.10.051. Epub 2010 Oct 20. Bioorg Med Chem Lett. 2011. PMID: 21078555 Free PMC article.
289 results