Protein domain-based prediction of drug/compound–target interactions and experimental validation on LIM kinases

• Tunca Doğan ,

  Roles Conceptualization, Data curation, Formal analysis, Investigation, Methodology, Project administration, Resources, Software, Supervision, Validation, Visualization, Writing – original draft, Writing – review & editing

  * E-mail: tuncadogan@gmail.com (TD); rengul@uchicago.edu (RCA)

  Affiliations Department of Computer Engineering, Hacettepe University, Ankara, Turkey, Institute of Informatics, Hacettepe University, Ankara, Turkey, CanSyL, Graduate School of Informatics, Middle East Technical University, Ankara, Turkey

  https://orcid.org/0000-0002-1298-9763

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• Ece Akhan Güzelcan,

  Roles Formal analysis, Investigation, Validation, Visualization, Writing – original draft

  Affiliations CanSyL, Graduate School of Informatics, Middle East Technical University, Ankara, Turkey, Center for Genomics and Rare Diseases & Biobank for Rare Diseases, Hacettepe University, Ankara, Turkey

  https://orcid.org/0000-0003-3239-5679

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• Marcus Baumann,

  Roles Formal analysis, Resources, Visualization, Writing – review & editing

  Affiliation School of Chemistry, University College Dublin, Dublin, Ireland

  https://orcid.org/0000-0002-6996-5893

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• Altay Koyas,

  Roles Formal analysis, Investigation, Validation, Visualization, Writing – original draft

  Affiliation CanSyL, Graduate School of Informatics, Middle East Technical University, Ankara, Turkey

  https://orcid.org/0000-0002-5436-6038

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• Heval Atas,

  Roles Formal analysis, Investigation, Validation, Visualization, Writing – original draft

  Affiliation CanSyL, Graduate School of Informatics, Middle East Technical University, Ankara, Turkey

  https://orcid.org/0000-0003-3180-7010

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• Ian R. Baxendale,

  Roles Project administration, Supervision, Writing – review & editing

  Affiliation Department of Chemistry, University of Durham, Durham, United Kingdom

  https://orcid.org/0000-0003-1297-1552

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• Maria Martin,

  Roles Conceptualization, Methodology, Project administration, Supervision, Writing – review & editing

  Affiliation European Molecular Biology Laboratory, European Bioinformatics Institute (EMBL-EBI), Wellcome Genome Campus, Hinxton, Cambridge, United Kingdom

  https://orcid.org/0000-0001-5454-2815

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• Rengul Cetin-Atalay

  Roles Conceptualization, Methodology, Project administration, Supervision, Writing – original draft, Writing – review & editing

  * E-mail: tuncadogan@gmail.com (TD); rengul@uchicago.edu (RCA)

  Affiliations CanSyL, Graduate School of Informatics, Middle East Technical University, Ankara, Turkey, Section of Pulmonary and Critical Care Medicine, University of Chicago, Chicago, Illinois, United States of America

  https://orcid.org/0000-0003-2408-6606

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