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Journal Abstract Search

1531 related items for PubMed ID: 20131845

  • 1. New substructure filters for removal of pan assay interference compounds (PAINS) from screening libraries and for their exclusion in bioassays.
    Baell JB, Holloway GA.
    J Med Chem; 2010 Apr 08; 53(7):2719-40. PubMed ID: 20131845
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  • 3. A high-throughput screen to identify novel calcineurin inhibitors.
    Margassery LM, Kennedy J, O'Gara F, Dobson AD, Morrissey JP.
    J Microbiol Methods; 2012 Jan 08; 88(1):63-6. PubMed ID: 22056231
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  • 5. Efficient hit-finding approaches for histone methyltransferases: the key parameters.
    Ahrens T, Bergner A, Sheppard D, Hafenbradl D.
    J Biomol Screen; 2012 Jan 08; 17(1):85-98. PubMed ID: 21990582
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  • 6. Scopy: an integrated negative design python library for desirable HTS/VS database design.
    Yang ZY, Yang ZJ, Lu AP, Hou TJ, Cao DS.
    Brief Bioinform; 2021 May 20; 22(3):. PubMed ID: 32892221
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  • 7. Benchmarking the mechanisms of frequent hitters: limitation of PAINS alerts.
    Yang ZY, Yang ZJ, He JH, Lu AP, Liu S, Hou TJ, Cao DS.
    Drug Discov Today; 2021 Jun 20; 26(6):1353-1358. PubMed ID: 33581116
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  • 10. Design of new plasmepsin inhibitors: a virtual high throughput screening approach on the EGEE grid.
    Kasam V, Zimmermann M, Maass A, Schwichtenberg H, Wolf A, Jacq N, Breton V, Hofmann-Apitius M.
    J Chem Inf Model; 2007 Jun 20; 47(5):1818-28. PubMed ID: 17727268
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  • 12. Highly Promiscuous Small Molecules from Biological Screening Assays Include Many Pan-Assay Interference Compounds but Also Candidates for Polypharmacology.
    Gilberg E, Jasial S, Stumpfe D, Dimova D, Bajorath J.
    J Med Chem; 2016 Nov 23; 59(22):10285-10290. PubMed ID: 27809519
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  • 14. Compound set enrichment: a novel approach to analysis of primary HTS data.
    Varin T, Gubler H, Parker CN, Zhang JH, Raman P, Ertl P, Schuffenhauer A.
    J Chem Inf Model; 2010 Dec 27; 50(12):2067-78. PubMed ID: 21073183
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  • 15. Hypothesis-driven screening.
    Schopfer U, Engeloch C, Höhn F, Mees H, Leeds J, Glickman F, Scheel G, Ferrand S, Fekkes P, Pfeifer M.
    Methods Mol Biol; 2009 Dec 27; 575():297-316. PubMed ID: 19727621
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  • 17. Hit-directed nearest-neighbor searching.
    Shanmugasundaram V, Maggiora GM, Lajiness MS.
    J Med Chem; 2005 Jan 13; 48(1):240-8. PubMed ID: 15634017
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  • 19. Broad coverage of commercially available lead-like screening space with fewer than 350,000 compounds.
    Baell JB.
    J Chem Inf Model; 2013 Jan 28; 53(1):39-55. PubMed ID: 23198812
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  • 20. Nuisance Compounds, PAINS Filters, and Dark Chemical Matter in the GSK HTS Collection.
    Chakravorty SJ, Chan J, Greenwood MN, Popa-Burke I, Remlinger KS, Pickett SD, Green DVS, Fillmore MC, Dean TW, Luengo JI, Macarrón R.
    SLAS Discov; 2018 Jul 28; 23(6):532-545. PubMed ID: 29699447
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