The Predictive QSAR Model for hERG Inhibitors Using Bayesian and Random Forest Classification Method
![]() ![]() |
Kim, Jun-Hyoung
(Drug Discovery Platform Technology Team, Korea Research Institute of Chemical Technology)
Chae, Chong-Hak (Drug Discovery Platform Technology Team, Korea Research Institute of Chemical Technology) Kang, Shin-Myung (Drug Discovery Platform Technology Team, Korea Research Institute of Chemical Technology) Lee, Joo-Yon (Drug Discovery Platform Technology Team, Korea Research Institute of Chemical Technology) Lee, Gil-Nam (Drug Discovery Platform Technology Team, Korea Research Institute of Chemical Technology) Hwang, Soon-Hee (Drug Discovery Platform Technology Team, Korea Research Institute of Chemical Technology) Kang, Nam-Sook (Drug Discovery Platform Technology Team, Korea Research Institute of Chemical Technology) |
1 | Song, M.; Clark, M. J. Chem. Inf. Model. 2006, 46, 392. DOI ScienceOn |
2 | Jia, L.; Sun, H. Bioorg. Med. Chem. 2008, 16, 6252. DOI ScienceOn |
3 | Tobita, M.; Nishikawa, T.; Nagashima, R. Bioorg. Med. Chem. Lett. 2005, 15, 2886. DOI ScienceOn |
4 | Leong, M. K. Chem. Res. Toxicol. 2007, 20, 217. DOI ScienceOn |
5 | Jaynes, E. T. Probability Theory: The Logic of Science. Cambridge University Press: London, 2003. |
6 | Breiman, L. Mach. Learn. 2001, 45, 5. DOI |
7 |
Thomson Reuters |
8 | Accelrys Software Inc., Pipeline Pilot Release 7.5, San Diego: Accelrys Software Inc., 2007. |
9 | Glick, M.; Jenkins, J. L.; Nettles, J. H.; Hitchings, H.; Davies, J. W. J. Chem. Inf. Model. 2006, 46, 193. DOI ScienceOn |
10 | Vandenberg, J. I.; Walker, B. D.; Campbell, T. J. Trends Pharmacol. Sci. 2001, 22, 240. DOI ScienceOn |
11 | Brown, A. M. Cell Calcium 2004, 35, 543. DOI ScienceOn |
12 | Aronov, A. M. Drug Discov. Today 2005, 10, 149. DOI ScienceOn |
13 | Mitcheson, J. S.; Chen, J.; Lin, M.; Culberson, C.; Sanguinetti, M. C. PNAS. 2000, 97, 12329. DOI ScienceOn |
14 | Pearlstein, R. A.; Vaz, R. J.; Kang, J.; Chen, X.-L.; Preobrazhenskaya, M.; Shchekotikhin, A. E.; Korolev, A. M.; Lysenkova, L. N.; Miroshnikova, O. V.; Hendrix, J.; Rampe, D. Bioorg. Med. Chem. Lett. 2003, 13, 1829. DOI ScienceOn |
15 | Du, L.; Li, M.; You, Q.; Xia, L. Biochem. Biophys. Res. Commun. 2007, 355, 889. DOI ScienceOn |
16 | Ekins, S.; Crumb, W. J.; Sarazan, R. D.; Wikel, J. H.; Wrighton, S. A. J. Pharmacol. Exp. Ther. 2002, 301, 427. DOI ScienceOn |
17 | Keserü, G. M. Bioorg. Med. Chem. Lett. 2003, 13, 2773. DOI ScienceOn |
18 | Cavalli, A.; Poluzzi, E.; De Ponti, F.; Recanatini, M. J. Med. Chem. 2002, 45, 3844. DOI ScienceOn |
19 | Thai, K. M.; Ecker, G. F. Chem. Biol. Drug Des. 2008, 72, 279. DOI ScienceOn |
20 | Sun, H. ChemMedChem 2006, 1, 315. DOI ScienceOn |
21 | Gepp, M. M.; Hutter, M. C. Bioorg. Med. Chem. 2006, 14, 5325. DOI ScienceOn |
![]() |