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PUBMED FOR HANDHELDS

Journal Abstract Search


197 related items for PubMed ID: 22486368

  • 1. Using novel descriptor accounting for ligand-receptor interactions to define and visually explore biologically relevant chemical space.
    Rabal O, Oyarzabal J.
    J Chem Inf Model; 2012 May 25; 52(5):1086-102. PubMed ID: 22486368
    [Abstract] [Full Text] [Related]

  • 2. Biologically relevant chemical space navigator: from patent and structure-activity relationship analysis to library acquisition and design.
    Rabal O, Oyarzabal J.
    J Chem Inf Model; 2012 Dec 21; 52(12):3123-37. PubMed ID: 23176522
    [Abstract] [Full Text] [Related]

  • 3. Bioactivity-guided navigation of chemical space.
    Bon RS, Waldmann H.
    Acc Chem Res; 2010 Aug 17; 43(8):1103-14. PubMed ID: 20481515
    [Abstract] [Full Text] [Related]

  • 4. GLIDA: GPCR-ligand database for chemical genomic drug discovery.
    Okuno Y, Yang J, Taneishi K, Yabuuchi H, Tsujimoto G.
    Nucleic Acids Res; 2006 Jan 01; 34(Database issue):D673-7. PubMed ID: 16381956
    [Abstract] [Full Text] [Related]

  • 5. Expanding the medicinally relevant chemical space with compound libraries.
    López-Vallejo F, Giulianotti MA, Houghten RA, Medina-Franco JL.
    Drug Discov Today; 2012 Jul 01; 17(13-14):718-26. PubMed ID: 22515962
    [Abstract] [Full Text] [Related]

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  • 9. Drug design strategies for targeting G-protein-coupled receptors.
    Klabunde T, Hessler G.
    Chembiochem; 2002 Oct 04; 3(10):928-44. PubMed ID: 12362358
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  • 10. Development and validation of AMANDA, a new algorithm for selecting highly relevant regions in Molecular Interaction Fields.
    Durán A, Martínez GC, Pastor M.
    J Chem Inf Model; 2008 Sep 04; 48(9):1813-23. PubMed ID: 18693718
    [Abstract] [Full Text] [Related]

  • 11. Structural interaction fingerprint (SIFt): a novel method for analyzing three-dimensional protein-ligand binding interactions.
    Deng Z, Chuaqui C, Singh J.
    J Med Chem; 2004 Jan 15; 47(2):337-44. PubMed ID: 14711306
    [Abstract] [Full Text] [Related]

  • 12. G-protein-coupled receptor-focused drug discovery using a target class platform approach.
    Heilker R, Wolff M, Tautermann CS, Bieler M.
    Drug Discov Today; 2009 Mar 15; 14(5-6):231-40. PubMed ID: 19121411
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  • 13. Flexible 3D pharmacophores as descriptors of dynamic biological space.
    Nettles JH, Jenkins JL, Williams C, Clark AM, Bender A, Deng Z, Davies JW, Glick M.
    J Mol Graph Model; 2007 Oct 15; 26(3):622-33. PubMed ID: 17395510
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  • 15. Fragment-based ligand discovery.
    Fischer M, Hubbard RE.
    Mol Interv; 2009 Feb 15; 9(1):22-30. PubMed ID: 19299661
    [Abstract] [Full Text] [Related]

  • 16. Strategies for designing GPCR-focused libraries and screening sets.
    Jimonet P, Jäger R.
    Curr Opin Drug Discov Devel; 2004 May 15; 7(3):325-33. PubMed ID: 15216936
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  • 17. Using chiral molecules as an approach to address low-druggability recognition sites.
    Lucas X, Günther S.
    J Comput Chem; 2014 Nov 05; 35(29):2114-21. PubMed ID: 25223950
    [Abstract] [Full Text] [Related]

  • 18. Large-scale similarity search profiling of ChEMBL compound data sets.
    Heikamp K, Bajorath J.
    J Chem Inf Model; 2011 Aug 22; 51(8):1831-9. PubMed ID: 21728295
    [Abstract] [Full Text] [Related]

  • 19. Ligand-based approach to in silico pharmacology: nuclear receptor profiling.
    Mestres J, Martín-Couce L, Gregori-Puigjané E, Cases M, Boyer S.
    J Chem Inf Model; 2006 Aug 22; 46(6):2725-36. PubMed ID: 17125212
    [Abstract] [Full Text] [Related]

  • 20. Structure-based druggability assessment--identifying suitable targets for small molecule therapeutics.
    Fauman EB, Rai BK, Huang ES.
    Curr Opin Chem Biol; 2011 Aug 22; 15(4):463-8. PubMed ID: 21704549
    [Abstract] [Full Text] [Related]


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