BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

203 related articles for article (PubMed ID: 9719584)

  • 21. Emerging chemical patterns: a new methodology for molecular classification and compound selection.
    Auer J; Bajorath J
    J Chem Inf Model; 2006; 46(6):2502-14. PubMed ID: 17125191
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Ligand-based virtual screening and in silico design of new antimalarial compounds using nonstochastic and stochastic total and atom-type quadratic maps.
    Marrero-Ponce Y; Iyarreta-Veitía M; Montero-Torres A; Romero-Zaldivar C; Brandt CA; Avila PE; Kirchgatter K; Machado Y
    J Chem Inf Model; 2005; 45(4):1082-100. PubMed ID: 16045304
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Prediction of milk/plasma concentration ratios of drugs and environmental pollutants.
    Abraham MH; Gil-Lostes J; Fatemi M
    Eur J Med Chem; 2009 Jun; 44(6):2452-8. PubMed ID: 19217191
    [TBL] [Abstract][Full Text] [Related]  

  • 24. QSAR modeling of anti-invasive activity of organic compounds using structural descriptors.
    Katritzky AR; Kuanar M; Dobchev DA; Vanhoecke BW; Karelson M; Parmar VS; Stevens CV; Bracke ME
    Bioorg Med Chem; 2006 Oct; 14(20):6933-9. PubMed ID: 16908166
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Quest for the rings. In silico exploration of ring universe to identify novel bioactive heteroaromatic scaffolds.
    Ertl P; Jelfs S; Mühlbacher J; Schuffenhauer A; Selzer P
    J Med Chem; 2006 Jul; 49(15):4568-73. PubMed ID: 16854061
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Prediction of pH-dependent aqueous solubility of druglike molecules.
    Hansen NT; Kouskoumvekaki I; Jørgensen FS; Brunak S; Jónsdóttir SO
    J Chem Inf Model; 2006; 46(6):2601-9. PubMed ID: 17125200
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Concept-based semi-automatic classification of drugs.
    Gurulingappa H; Kolárik C; Hofmann-Apitius M; Fluck J
    J Chem Inf Model; 2009 Aug; 49(8):1986-92. PubMed ID: 19663460
    [TBL] [Abstract][Full Text] [Related]  

  • 28. ADME evaluation in drug discovery. 8. The prediction of human intestinal absorption by a support vector machine.
    Hou T; Wang J; Li Y
    J Chem Inf Model; 2007; 47(6):2408-15. PubMed ID: 17929911
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Comparison of support vector machine and artificial neural network systems for drug/nondrug classification.
    Byvatov E; Fechner U; Sadowski J; Schneider G
    J Chem Inf Comput Sci; 2003; 43(6):1882-9. PubMed ID: 14632437
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Drug discovery using support vector machines. The case studies of drug-likeness, agrochemical-likeness, and enzyme inhibition predictions.
    Zernov VV; Balakin KV; Ivaschenko AA; Savchuk NP; Pletnev IV
    J Chem Inf Comput Sci; 2003; 43(6):2048-56. PubMed ID: 14632457
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Using general regression and probabilistic neural networks to predict human intestinal absorption with topological descriptors derived from two-dimensional chemical structures.
    Niwa T
    J Chem Inf Comput Sci; 2003; 43(1):113-9. PubMed ID: 12546543
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Predicting oral druglikeness by iterative stochastic elimination.
    Rayan A; Marcus D; Goldblum A
    J Chem Inf Model; 2010 Mar; 50(3):437-45. PubMed ID: 20170135
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Bioisosteric similarity of molecules based on structural alignment and observed chemical replacements in drugs.
    Krier M; Hutter MC
    J Chem Inf Model; 2009 May; 49(5):1280-97. PubMed ID: 19402687
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Property distributions: differences between drugs, natural products, and molecules from combinatorial chemistry.
    Feher M; Schmidt JM
    J Chem Inf Comput Sci; 2003; 43(1):218-27. PubMed ID: 12546556
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Property-based design of GPCR-targeted library.
    Balakin KV; Tkachenko SE; Lang SA; Okun I; Ivashchenko AA; Savchuk NP
    J Chem Inf Comput Sci; 2002; 42(6):1332-42. PubMed ID: 12444729
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Predictive activity profiling of drugs by topological-fragment-spectra-based support vector machines.
    Kawai K; Fujishima S; Takahashi Y
    J Chem Inf Model; 2008 Jun; 48(6):1152-60. PubMed ID: 18533712
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Structure-based versus property-based approaches in the design of G-protein-coupled receptor-targeted libraries.
    Balakin KV; Lang SA; Skorenko AV; Tkachenko SE; Ivashchenko AA; Savchuk NP
    J Chem Inf Comput Sci; 2003; 43(5):1553-62. PubMed ID: 14502489
    [TBL] [Abstract][Full Text] [Related]  

  • 38. 'Metabolite-likeness' as a criterion in the design and selection of pharmaceutical drug libraries.
    Dobson PD; Patel Y; Kell DB
    Drug Discov Today; 2009 Jan; 14(1-2):31-40. PubMed ID: 19049901
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Modeling of human cytochrome p450-mediated drug metabolism using unsupervised machine learning approach.
    Korolev D; Balakin KV; Nikolsky Y; Kirillov E; Ivanenkov YA; Savchuk NP; Ivashchenko AA; Nikolskaya T
    J Med Chem; 2003 Aug; 46(17):3631-43. PubMed ID: 12904067
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Property distribution of drug-related chemical databases.
    Oprea TI
    J Comput Aided Mol Des; 2000 Mar; 14(3):251-64. PubMed ID: 10756480
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 11.