Sun H - Search Results

1

Predictive models of aqueous solubility of organic compounds built on A large dataset of high integrity.

Sun H, Shah P, Nguyen K, Yu KR, Kerns E, Kabir M, Wang Y, Xu X. Sun H, et al. Bioorg Med Chem. 2019 Jul 15;27(14):3110-3114. doi: 10.1016/j.bmc.2019.05.037. Epub 2019 May 27. Bioorg Med Chem. 2019. PMID: 31176566 Free PMC article.

2

A naive bayes classifier for prediction of multidrug resistance reversal activity on the basis of atom typing.

Sun H. Sun H. J Med Chem. 2005 Jun 16;48(12):4031-9. doi: 10.1021/jm050180t. J Med Chem. 2005. PMID: 15943476

3

Are hERG channel blockers also phospholipidosis inducers?

Sun H, Xia M, Shahane SA, Jadhav A, Austin CP, Huang R. Sun H, et al. Bioorg Med Chem Lett. 2013 Aug 15;23(16):4587-90. doi: 10.1016/j.bmcl.2013.06.034. Epub 2013 Jun 20. Bioorg Med Chem Lett. 2013. PMID: 23856051 Free PMC article.

4

Discovery of NCT-501, a Potent and Selective Theophylline-Based Inhibitor of Aldehyde Dehydrogenase 1A1 (ALDH1A1).

Yang SM, Yasgar A, Miller B, Lal-Nag M, Brimacombe K, Hu X, Sun H, Wang A, Xu X, Nguyen K, Oppermann U, Ferrer M, Vasiliou V, Simeonov A, Jadhav A, Maloney DJ. Yang SM, et al. Among authors: sun h. J Med Chem. 2015 Aug 13;58(15):5967-78. doi: 10.1021/acs.jmedchem.5b00577. Epub 2015 Jul 24. J Med Chem. 2015. PMID: 26207746 Free PMC article.

5

A High-Throughput Screen Identifies 2,9-Diazaspiro[5.5]Undecanes as Inducers of the Endoplasmic Reticulum Stress Response with Cytotoxic Activity in 3D Glioma Cell Models.

Martinez NJ, Rai G, Yasgar A, Lea WA, Sun H, Wang Y, Luci DK, Yang SM, Nishihara K, Takeda S, Sagor M, Earnshaw I, Okada T, Mori K, Wilson K, Riggins GJ, Xia M, Grimaldi M, Jadhav A, Maloney DJ, Simeonov A. Martinez NJ, et al. Among authors: sun h. PLoS One. 2016 Aug 29;11(8):e0161486. doi: 10.1371/journal.pone.0161486. eCollection 2016. PLoS One. 2016. PMID: 27570969 Free PMC article.

6

Prediction of hERG Liability - Using SVM Classification, Bootstrapping and Jackknifing.

Sun H, Huang R, Xia M, Shahane S, Southall N, Wang Y. Sun H, et al. Mol Inform. 2017 Apr;36(4):10.1002/minf.201600126. doi: 10.1002/minf.201600126. Epub 2016 Dec 21. Mol Inform. 2017. PMID: 28000393 Free PMC article.

7

Highly predictive and interpretable models for PAMPA permeability.

Sun H, Nguyen K, Kerns E, Yan Z, Yu KR, Shah P, Jadhav A, Xu X. Sun H, et al. Bioorg Med Chem. 2017 Feb 1;25(3):1266-1276. doi: 10.1016/j.bmc.2016.12.049. Epub 2016 Dec 31. Bioorg Med Chem. 2017. PMID: 28082071 Free PMC article.

8

Physiologically relevant orthogonal assays for the discovery of small-molecule modulators of WIP1 phosphatase in high-throughput screens.

Clausse V, Tao D, Debnath S, Fang Y, Tagad HD, Wang Y, Sun H, LeClair CA, Mazur SJ, Lane K, Shi ZD, Vasalatiy O, Eells R, Baker LK, Henderson MJ, Webb MR, Shen M, Hall MD, Appella E, Appella DH, Coussens NP. Clausse V, et al. Among authors: sun h. J Biol Chem. 2019 Nov 15;294(46):17654-17668. doi: 10.1074/jbc.RA119.010201. Epub 2019 Sep 3. J Biol Chem. 2019. PMID: 31481464 Free PMC article.

9

Predictive models for estimating cytotoxicity on the basis of chemical structures.

Sun H, Wang Y, Cheff DM, Hall MD, Shen M. Sun H, et al. Bioorg Med Chem. 2020 May 15;28(10):115422. doi: 10.1016/j.bmc.2020.115422. Epub 2020 Mar 12. Bioorg Med Chem. 2020. PMID: 32234277 Free PMC article.

10

Deep Graph Learning with Property Augmentation for Predicting Drug-Induced Liver Injury.

Ma H, An W, Wang Y, Sun H, Huang R, Huang J. Ma H, et al. Among authors: sun h. Chem Res Toxicol. 2021 Feb 15;34(2):495-506. doi: 10.1021/acs.chemrestox.0c00322. Epub 2020 Dec 21. Chem Res Toxicol. 2021. PMID: 33347312 Free PMC article.

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