{
  "version": "https://jsonfeed.org/version/1.1",
  "title": "chem-bla-ics",
  "description": "Chemblaics (pronounced chem-bla-ics) is the science that uses open science and computers to solve problems in chemistry, biochemistry and related fields.",
  "home_page_url": "https://chem-bla-ics.linkedchemistry.info/",
  "feed_url": "https://chem-bla-ics.linkedchemistry.info/2006/10/11/are-chemogenomics-and.json",
  "icon": "https://chem-bla-ics.linkedchemistry.info/assets/images/chem-bla-ics_logo.png",
  "language": "en",
  "authors": [
    {
      "name": "Egon Willighagen",
      "url": "https://orcid.org/0000-0001-7542-0286",
      "_orcid": "0000-0001-7542-0286"
    }
  ],
  "items": [

    {
      "id": "https://doi.org/10.59350/a587x-jvp62",
      "url": "https://chem-bla-ics.linkedchemistry.info/2006/10/11/are-chemogenomics-and.html",
      "title": "Are chemogenomics and proteochemometrics the same?",
      "content_html": "<p><a href=\"http://www.blogger.com/profile/2366764\">Joerg Wegner</a> <a href=\"http://miningdrugs.blogspot.com/2006/09/chemogenomics-structuring-drug.html\">recently blogged</a>\nabout <em>Chemogenomics: structuring the drug discovery process to gene families</em> by C.J. Harris and A. P. Stevens in Drug Discov Today\n(DOI: <a href=\"https://doi.org/10.1016/j.drudis.2006.08.013\">10.1016/j.drudis.2006.08.013</a>). This review article provides a nice overview of a trend in\nmathematical modelling of the interaction of small organic molecules with proteins, often referred to as <a href=\"http://en.wikipedia.org/wiki/QSAR\">QSAR</a>.\nWhat the article does not discuss, is the <a href=\"http://www.proteochemometrics.org/index.php?option=com_content&amp;task=view&amp;id=20&amp;Itemid=22\">work by the group of Jarl Wikberg</a>\nwho coined the term proteochemometrics (see PubMed: <a href=\"https://pubmed.ncbi.nlm.nih.gov/11342268/\">11342268</a>).</p>\n\n<h4>References</h4>\n<div class=\"csl-bib-body\">\n    <div class=\"csl-entry\">Harris, C. J., &#38; Stevens, A. P. (2006). Chemogenomics: structuring the drug discovery process to gene families. <i>Drug Discovery Today</i>, <i>11</i>(19–20), 880–888. https://doi.org/10.1016/j.drudis.2006.08.013 <a href=\"https://doi.org/10.1016/j.drudis.2006.08.013\">CrossRef</a> <a href=\"https://qlever.scholia.wiki/doi/10.1016/j.drudis.2006.08.013\">Scholia</a></div>\n    <div class=\"csl-entry\">Lapinsh, M., Prusis, P., Gutcaits, A., Lundstedt, T., &#38; Wikberg, J. E. S. (2001). Development of proteo-chemometrics: a novel technology for the analysis of drug-receptor interactions. <i>Biochimica et Biophysica Acta (BBA) - General Subjects</i>, <i>1525</i>(1–2), 180–190. https://doi.org/10.1016/s0304-4165(00)00187-2 <a href=\"https://doi.org/10.1016/s0304-4165(00)00187-2\">CrossRef</a> <a href=\"https://qlever.scholia.wiki/doi/10.1016/s0304-4165(00)00187-2\">Scholia</a></div>\n  </div>",
      "summary": "Joerg Wegner recently blogged about Chemogenomics: structuring the drug discovery process to gene families by C.J. Harris and A. P. Stevens in Drug Discov Today (DOI: 10.1016/j.drudis.2006.08.013). This review article provides a nice overview of a trend in mathematical modelling of the interaction of small organic molecules with proteins, often referred to as QSAR. What the article does not discuss, is the work by the group of Jarl Wikberg who coined the term proteochemometrics (see PubMed: 11342268).",
      
      "date_published": "2006-10-11T00:00:00+00:00",
      "date_modified": "2025-02-16T00:00:00+00:00",
      "tags": ["cheminf","bioinfo"],
      "_references": [
        
          
          
            { "url": "https://doi.org/10.1016/j.drudis.2006.08.013", "doi": "10.1016/j.drudis.2006.08.013"
             }
            ,
          
        
          
          
            { "url": "https://doi.org/10.1016/s0304-4165(00)00187-2", "doi": "10.1016/s0304-4165(00)00187-2"
             }
            
          
        ],
      
      
      
      
      
      
        "authors": [ { "name": "Egon Willighagen", "url": "https://orcid.org/0000-0001-7542-0286" } ]
      
    }

  ]
}