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  <front>
    <journal-meta>
      <journal-id journal-id-type="iso-abbrev">Pharmacophore</journal-id>
      <journal-id journal-id-type="publisher-id">pharmacophorejournal.com</journal-id>
      <journal-id journal-id-type="publisher-id">Pharmacophore</journal-id>
      <journal-title-group>
        <journal-title>Pharmacophore</journal-title>
      </journal-title-group>
      <issn pub-type="epub">2229-5402</issn>
    </journal-meta>
    <article-meta>
      <article-id pub-id-type="publisher-id">pharmacophorejournal.com-6978</article-id>
      <article-id pub-id-type="doi">10.51847/44vwgWGyvz</article-id>
      <article-categories>
        <subj-group subj-group-type="heading">
          <subject>Original research</subject>
        </subj-group>
      </article-categories>
      <title-group>
        <article-title>What Transfers from Molecules to Medicines? A Systematic Review of Foundation Models across Pharmaceutical Scales</article-title>
      </title-group>
                    <contrib-group>
                      <contrib contrib-type="author">
              <name>
                <surname>Walker</surname>
                <given-names>James</given-names>
              </name>
                              <xref rid="aff1" ref-type="aff">1</xref>
                                                            <xref rid="cor1" ref-type="corresp" />
                          </contrib>
                      <contrib contrib-type="author">
              <name>
                <surname>Harris</surname>
                <given-names>Olivia</given-names>
              </name>
                              <xref rid="aff1" ref-type="aff">1</xref>
                                        </contrib>
                      <contrib contrib-type="author">
              <name>
                <surname>Wilson</surname>
                <given-names>George</given-names>
              </name>
                              <xref rid="aff2" ref-type="aff">2</xref>
                                        </contrib>
                  </contrib-group>
                  <aff id="aff1">
            <label>1</label>Department of Foundation Model Transfer from Molecules to Medicines, Faculty of Pharmacy, University of Edinburgh, Edinburgh, United Kingdom.
          </aff>
                  <aff id="aff2">
            <label>2</label>Department of Multi-Scale Foundation Model Evaluation, Faculty of Pharmacy, University of Leeds, Leeds, United Kingdom.
          </aff>
                          <author-notes>
            <corresp id="cor1">
              <bold>Address for correspondence:</bold> Prof. Wael Abu Dayyih, Department of
              Pharmaceutical Chemistry, Faculty of Pharmacy, Mutah University, Al-Karak 61710, Jordan.
                              E-mail: <email xlink:href="james.walker@ed.ac.uk">james.walker@ed.ac.uk</email>
                          </corresp>
          </author-notes>
                    <pub-date pub-type="epub">
        <day>28</day>
        <month>08</month>
        <year>2026</year>
      </pub-date>
      <volume>17</volume>
      <issue>4</issue>
      <fpage>125</fpage>
      <lpage>134</lpage>
      <permissions>
        <copyright-statement>
          Copyright: &#x000a9; 2026 Pharmacophore
        </copyright-statement>
        <copyright-year>2026</copyright-year>
        <license>
          <ali:license_ref xmlns:ali="http://www.niso.org/schemas/ali/1.0/"
            specific-use="textmining" content-type="ccbyncsalicense">
            https://creativecommons.org/licenses/by-nc-sa/4.0/</ali:license_ref>
          <license-p>This is an open access journal, and articles are distributed under the terms of
            the Creative Commons Attribution-NonCommercial-ShareAlike 4.0 License, which allows
            others to remix, tweak, and build upon the work non-commercially, as long as appropriate
            credit is given and the new creations are licensed under the identical terms.</license-p>
        </license>
      </permissions>
      <abstract>
        <title>A<sc>BSTRACT</sc></title>
        <p>Foundation models are increasingly used to encode chemical structures, protein sequences, three-dimensional conformations, cellular states, biomedical knowledge, and clinical narratives. Their shared premise is that large-scale pretraining can produce reusable representations that reduce task-specific data requirements and support adaptation to multiple pharmaceutical problems. The unresolved issue is not whether such representations can improve selected benchmarks, but what information transfers across pharmaceutical scales and which evidence is required before transfer can influence medicine-development decisions. This systematic review evaluates foundation-model evidence using two complementary dimensions: scale distance, extending from molecules through proteins, structures, cells, omics, disease contexts, and development decisions; and evidence distance, extending from internal benchmark capability through external evaluation, experimental confirmation, prospective decision impact, and bounded operational readiness. Protocol-defined searching, eligibility assessment, qualitative risk-of-bias appraisal, structured evidence extraction, and narrative synthesis were used to distinguish demonstrated capability from plausible utility and translational value. The synthesis indicates that transfer is most convincingly demonstrated within individual modalities or between closely adjacent biological scales. Cross-scale claims become less secure when representations must preserve mechanistic relevance across changing assays, biological contexts, populations, or decision environments. Adaptation, grounding, calibration, leakage control, external validation, and experimental confirmation therefore function as evidence gates rather than optional performance refinements. A scale-aware interpretation of foundation models is proposed in which transfer is treated as a validated relationship among a source representation, target task, changed context, and decision consequence. The available evidence remains heterogeneous, frequently benchmark-centred, and insufficient to establish routine pharmaceutical readiness. Progress will require evaluation designs that connect representation reuse to reproducible, externally valid, and experimentally consequential decisions.</p>
      </abstract>
      <kwd-group>
                <kwd>Foundation models</kwd>
                <kwd>Pharmaceutical scales</kwd>
                <kwd>Transfer learning</kwd>
                <kwd>Molecular representation</kwd>
                <kwd>Protein language models</kwd>
                <kwd>Multi-omics</kwd>
              </kwd-group>
    </article-meta>
  </front>
</article>