Jenkins J - Search Results

1

Cheminformatics Tools for Analyzing and Designing Optimized Small-Molecule Collections and Libraries.

Moret N, Clark NA, Hafner M, Wang Y, Lounkine E, Medvedovic M, Wang J, Gray N, Jenkins J, Sorger PK. Moret N, et al. Among authors: jenkins j. Cell Chem Biol. 2019 May 16;26(5):765-777.e3. doi: 10.1016/j.chembiol.2019.02.018. Epub 2019 Apr 4. Cell Chem Biol. 2019. PMID: 30956147 Free PMC article.

2

Integrating high-content screening and ligand-target prediction to identify mechanism of action.

Young DW, Bender A, Hoyt J, McWhinnie E, Chirn GW, Tao CY, Tallarico JA, Labow M, Jenkins JL, Mitchison TJ, Feng Y. Young DW, et al. Among authors: jenkins jl. Nat Chem Biol. 2008 Jan;4(1):59-68. doi: 10.1038/nchembio.2007.53. Epub 2007 Dec 9. Nat Chem Biol. 2008. PMID: 18066055

3

Computational methods for early predictive safety assessment from biological and chemical data.

Nigsch F, Lounkine E, McCarren P, Cornett B, Glick M, Azzaoui K, Urban L, Marc P, Müller A, Hahne F, Heard DJ, Jenkins JL. Nigsch F, et al. Among authors: jenkins jl. Expert Opin Drug Metab Toxicol. 2011 Dec;7(12):1497-511. doi: 10.1517/17425255.2011.632632. Epub 2011 Nov 4. Expert Opin Drug Metab Toxicol. 2011. PMID: 22050465 Review.

4

Activity-aware clustering of high throughput screening data and elucidation of orthogonal structure-activity relationships.

Lounkine E, Nigsch F, Jenkins JL, Glick M. Lounkine E, et al. J Chem Inf Model. 2011 Dec 27;51(12):3158-68. doi: 10.1021/ci2004994. Epub 2011 Dec 7. J Chem Inf Model. 2011. PMID: 22098146

5

Rethinking molecular similarity: comparing compounds on the basis of biological activity.

Petrone PM, Simms B, Nigsch F, Lounkine E, Kutchukian P, Cornett A, Deng Z, Davies JW, Jenkins JL, Glick M. Petrone PM, et al. ACS Chem Biol. 2012 Aug 17;7(8):1399-409. doi: 10.1021/cb3001028. Epub 2012 May 31. ACS Chem Biol. 2012. PMID: 22594495

6

Large-scale prediction and testing of drug activity on side-effect targets.

Lounkine E, Keiser MJ, Whitebread S, Mikhailov D, Hamon J, Jenkins JL, Lavan P, Weber E, Doak AK, Côté S, Shoichet BK, Urban L. Lounkine E, et al. Among authors: jenkins jl. Nature. 2012 Jun 10;486(7403):361-7. doi: 10.1038/nature11159. Nature. 2012. PMID: 22722194 Free PMC article.

7

Biodiversity of small molecules--a new perspective in screening set selection.

Petrone PM, Wassermann AM, Lounkine E, Kutchukian P, Simms B, Jenkins J, Selzer P, Glick M. Petrone PM, et al. Among authors: jenkins j. Drug Discov Today. 2013 Jul;18(13-14):674-80. doi: 10.1016/j.drudis.2013.02.005. Epub 2013 Feb 20. Drug Discov Today. 2013. PMID: 23454345

8

Using information from historical high-throughput screens to predict active compounds.

Riniker S, Wang Y, Jenkins JL, Landrum GA. Riniker S, et al. J Chem Inf Model. 2014 Jul 28;54(7):1880-91. doi: 10.1021/ci500190p. Epub 2014 Jun 26. J Chem Inf Model. 2014. PMID: 24933016

9

Evidence-Based and Quantitative Prioritization of Tool Compounds in Phenotypic Drug Discovery.

Wang Y, Cornett A, King FJ, Mao Y, Nigsch F, Paris CG, McAllister G, Jenkins JL. Wang Y, et al. Among authors: jenkins jl. Cell Chem Biol. 2016 Jul 21;23(7):862-874. doi: 10.1016/j.chembiol.2016.05.016. Epub 2016 Jul 14. Cell Chem Biol. 2016. PMID: 27427232 Free article.

10

Quantitative Prioritization of Tool Compounds for Phenotypic Screening.

Wang Y, Jenkins JL. Wang Y, et al. Methods Mol Biol. 2018;1787:195-206. doi: 10.1007/978-1-4939-7847-2_15. Methods Mol Biol. 2018. PMID: 29736720

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