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Journal Abstract Search


84 related items for PubMed ID: 15598553

  • 1. Structure-based discovery of human L-xylulose reductase inhibitors from database screening and molecular docking.
    Carbone V, Ishikura S, Hara A, El-Kabbani O.
    Bioorg Med Chem; 2005 Jan 17; 13(2):301-12. PubMed ID: 15598553
    [Abstract] [Full Text] [Related]

  • 2. Crystal structure of human L-xylulose reductase holoenzyme: probing the role of Asn107 with site-directed mutagenesis.
    El-Kabbani O, Ishikura S, Darmanin C, Carbone V, Chung RP, Usami N, Hara A.
    Proteins; 2004 May 15; 55(3):724-32. PubMed ID: 15103634
    [Abstract] [Full Text] [Related]

  • 3. Structure of the tetrameric form of human L-Xylulose reductase: probing the inhibitor-binding site with molecular modeling and site-directed mutagenesis.
    El-Kabbani O, Carbone V, Darmanin C, Ishikura S, Hara A.
    Proteins; 2005 Aug 15; 60(3):424-32. PubMed ID: 15906319
    [Abstract] [Full Text] [Related]

  • 4. Structure-based design of inhibitors of human L-xylulose reductase modelled into the active site of the enzyme.
    Carbone V, Darmanin C, Ishikura S, Hara A, El-Kabbani O.
    Bioorg Med Chem Lett; 2003 Apr 17; 13(8):1469-74. PubMed ID: 12668014
    [Abstract] [Full Text] [Related]

  • 5. Importance of molecular computer modeling in anticancer drug development.
    Geromichalos GD.
    J BUON; 2007 Sep 17; 12 Suppl 1():S101-18. PubMed ID: 17935268
    [Abstract] [Full Text] [Related]

  • 6. An artificial intelligence approach to the study of the structural moieties relevant to drug-receptor interactions in aldose reductase inhibitors.
    Klopman G, Buyukbingol E.
    Mol Pharmacol; 1988 Dec 17; 34(6):852-62. PubMed ID: 3143909
    [Abstract] [Full Text] [Related]

  • 7. Discovery of small molecule inhibitors of integrin alphavbeta3 through structure-based virtual screening.
    Zhou Y, Peng H, Ji Q, Qi J, Zhu Z, Yang C.
    Bioorg Med Chem Lett; 2006 Nov 15; 16(22):5878-82. PubMed ID: 16982193
    [Abstract] [Full Text] [Related]

  • 8. Structure basis for the inhibitory mechanism of a novel DNase gamma-specific inhibitor, DR396.
    Sunaga S, Yoshimori A, Shiokawa D, Tanuma S.
    Bioorg Med Chem; 2006 Jun 15; 14(12):4217-26. PubMed ID: 16574417
    [Abstract] [Full Text] [Related]

  • 9. Virtual screening and scaffold hopping based on GRID molecular interaction fields.
    Ahlström MM, Ridderström M, Luthman K, Zamora I.
    J Chem Inf Model; 2005 Jun 15; 45(5):1313-23. PubMed ID: 16180908
    [Abstract] [Full Text] [Related]

  • 10. Mining the NCI antiviral compounds for HIV-1 integrase inhibitors.
    Deng J, Kelley JA, Barchi JJ, Sanchez T, Dayam R, Pommier Y, Neamati N.
    Bioorg Med Chem; 2006 Jun 01; 14(11):3785-92. PubMed ID: 16460953
    [Abstract] [Full Text] [Related]

  • 11. Automatic and efficient decomposition of two-dimensional structures of small molecules for fragment-based high-throughput docking.
    Kolb P, Caflisch A.
    J Med Chem; 2006 Dec 14; 49(25):7384-92. PubMed ID: 17149868
    [Abstract] [Full Text] [Related]

  • 12. Protein structure-based de novo design and synthesis of aldose reductase inhibitors.
    Iwata Y, Naito S, Itai A, Miyamoto S.
    Drug Des Discov; 2001 Dec 14; 17(4):349-59. PubMed ID: 11765138
    [Abstract] [Full Text] [Related]

  • 13. Diketo acid pharmacophore. 2. Discovery of structurally diverse inhibitors of HIV-1 integrase.
    Dayam R, Sanchez T, Neamati N.
    J Med Chem; 2005 Dec 15; 48(25):8009-15. PubMed ID: 16335925
    [Abstract] [Full Text] [Related]

  • 14. Human sialidase inhibitors: design, synthesis, and biological evaluation of 4-acetamido-5-acylamido-2-fluoro benzoic acids.
    Magesh S, Savita V, Moriya S, Suzuki T, Miyagi T, Ishida H, Kiso M.
    Bioorg Med Chem; 2009 Jul 01; 17(13):4595-603. PubMed ID: 19450982
    [Abstract] [Full Text] [Related]

  • 15. Identification of some novel AHAS inhibitors via molecular docking and virtual screening approach.
    Wang JG, Xiao YJ, Li YH, Ma Y, Li ZM.
    Bioorg Med Chem; 2007 Jan 01; 15(1):374-80. PubMed ID: 17049866
    [Abstract] [Full Text] [Related]

  • 16. N-(thiazol-2-yl)-2-thiophene carboxamide derivatives as Abl inhibitors identified by a pharmacophore-based database screening of commercially available compounds.
    Manetti F, Falchi F, Crespan E, Schenone S, Maga G, Botta M.
    Bioorg Med Chem Lett; 2008 Aug 01; 18(15):4328-31. PubMed ID: 18621522
    [Abstract] [Full Text] [Related]

  • 17. Synthesis and docking studies of new 1,4-dihydropyridines containing 4-(5)-Chloro-2-ethyl-5-(4)-imidazolyl substituent as novel calcium channel agonist.
    Davood A, Nematollahi AR, Iman M, Shafiee A.
    Arch Pharm Res; 2009 Apr 01; 32(4):481-7. PubMed ID: 19407963
    [Abstract] [Full Text] [Related]

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  • 20. Quantitative evaluation of each catalytic subsite of cathepsin B for inhibitory activity based on inhibitory activity-binding mode relationship of epoxysuccinyl inhibitors by X-ray crystal structure analyses of complexes.
    Watanabe D, Yamamoto A, Tomoo K, Matsumoto K, Murata M, Kitamura K, Ishida T.
    J Mol Biol; 2006 Oct 06; 362(5):979-93. PubMed ID: 16950396
    [Abstract] [Full Text] [Related]


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