{"id":"https://openalex.org/W2920735258","doi":"https://doi.org/10.1021/acs.jcim.8b00832","title":"Advances and Challenges in Computational Target Prediction","display_name":"Advances and Challenges in Computational Target Prediction","publication_year":2019,"publication_date":"2019-02-28","ids":{"openalex":"https://openalex.org/W2920735258","doi":"https://doi.org/10.1021/acs.jcim.8b00832","mag":"2920735258","pmid":"https://pubmed.ncbi.nlm.nih.gov/30817146"},"language":"en","primary_location":{"id":"doi:10.1021/acs.jcim.8b00832","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jcim.8b00832","pdf_url":null,"source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},"type":"review","indexed_in":["crossref","pubmed"],"open_access":{"is_oa":true,"oa_status":"green","oa_url":"https://hdl.handle.net/1887/77053","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5071001630","display_name":"Dominique Sydow","orcid":null},"institutions":[{"id":"https://openalex.org/I7877124","display_name":"Charit\u00e9 - Universit\u00e4tsmedizin Berlin","ror":"https://ror.org/001w7jn25","country_code":"DE","type":"healthcare","lineage":["https://openalex.org/I7877124"]}],"countries":["DE"],"is_corresponding":false,"raw_author_name":"Dominique Sydow","raw_affiliation_strings":["In silico Toxicology, Institute of Physiology, Charit\u00e9 \u2212 Universit\u00e4tsmedizin Berlin, Charit\u00e9platz 1, 10117 Berlin, Germany"],"affiliations":[{"raw_affiliation_string":"In silico Toxicology, Institute of Physiology, Charit\u00e9 \u2212 Universit\u00e4tsmedizin Berlin, Charit\u00e9platz 1, 10117 Berlin, Germany","institution_ids":["https://openalex.org/I7877124"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5030165076","display_name":"Lindsey Burggraaff","orcid":"https://orcid.org/0000-0002-2442-0443"},"institutions":[{"id":"https://openalex.org/I121797337","display_name":"Leiden University","ror":"https://ror.org/027bh9e22","country_code":"NL","type":"education","lineage":["https://openalex.org/I121797337"]},{"id":"https://openalex.org/I4210133171","display_name":"Centre for Human Drug Research","ror":"https://ror.org/044hshx49","country_code":"NL","type":"facility","lineage":["https://openalex.org/I4210133171"]}],"countries":["NL"],"is_corresponding":false,"raw_author_name":"Lindsey Burggraaff","raw_affiliation_strings":["Division of Drug Discovery and Safety, Leiden Academic Centre for Drug Research, Leiden University, P.O. Box 9502, 2300 RA, Leiden, The Netherlands"],"affiliations":[{"raw_affiliation_string":"Division of Drug Discovery and Safety, Leiden Academic Centre for Drug Research, Leiden University, P.O. Box 9502, 2300 RA, Leiden, The Netherlands","institution_ids":["https://openalex.org/I4210133171","https://openalex.org/I121797337"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5083906099","display_name":"Angelika Szengel","orcid":null},"institutions":[{"id":"https://openalex.org/I7877124","display_name":"Charit\u00e9 - Universit\u00e4tsmedizin Berlin","ror":"https://ror.org/001w7jn25","country_code":"DE","type":"healthcare","lineage":["https://openalex.org/I7877124"]}],"countries":["DE"],"is_corresponding":false,"raw_author_name":"Angelika Szengel","raw_affiliation_strings":["In silico Toxicology, Institute of Physiology, Charit\u00e9 \u2212 Universit\u00e4tsmedizin Berlin, Charit\u00e9platz 1, 10117 Berlin, Germany"],"affiliations":[{"raw_affiliation_string":"In silico Toxicology, Institute of Physiology, Charit\u00e9 \u2212 Universit\u00e4tsmedizin Berlin, Charit\u00e9platz 1, 10117 Berlin, Germany","institution_ids":["https://openalex.org/I7877124"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5015253529","display_name":"Herman van Vlijmen","orcid":"https://orcid.org/0000-0002-1915-3141"},"institutions":[{"id":"https://openalex.org/I121797337","display_name":"Leiden University","ror":"https://ror.org/027bh9e22","country_code":"NL","type":"education","lineage":["https://openalex.org/I121797337"]},{"id":"https://openalex.org/I137982388","display_name":"Janssen (Belgium)","ror":"https://ror.org/04yzcpd71","country_code":"BE","type":"company","lineage":["https://openalex.org/I1330063522","https://openalex.org/I137982388"]},{"id":"https://openalex.org/I4210133171","display_name":"Centre for Human Drug Research","ror":"https://ror.org/044hshx49","country_code":"NL","type":"facility","lineage":["https://openalex.org/I4210133171"]}],"countries":["BE","NL"],"is_corresponding":false,"raw_author_name":"Herman W. T. van Vlijmen","raw_affiliation_strings":["Computational Chemistry, Janssen Research & Development, Turnhoutseweg 30, B-2340 Beerse, Belgium","Division of Drug Discovery and Safety, Leiden Academic Centre for Drug Research, Leiden University, P.O. Box 9502, 2300 RA, Leiden, The Netherlands"],"affiliations":[{"raw_affiliation_string":"Computational Chemistry, Janssen Research & Development, Turnhoutseweg 30, B-2340 Beerse, Belgium","institution_ids":["https://openalex.org/I137982388"]},{"raw_affiliation_string":"Division of Drug Discovery and Safety, Leiden Academic Centre for Drug Research, Leiden University, P.O. Box 9502, 2300 RA, Leiden, The Netherlands","institution_ids":["https://openalex.org/I4210133171","https://openalex.org/I121797337"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5065525958","display_name":"Adriaan P. IJzerman","orcid":"https://orcid.org/0000-0002-1182-2259"},"institutions":[{"id":"https://openalex.org/I121797337","display_name":"Leiden University","ror":"https://ror.org/027bh9e22","country_code":"NL","type":"education","lineage":["https://openalex.org/I121797337"]},{"id":"https://openalex.org/I4210133171","display_name":"Centre for Human Drug Research","ror":"https://ror.org/044hshx49","country_code":"NL","type":"facility","lineage":["https://openalex.org/I4210133171"]}],"countries":["NL"],"is_corresponding":false,"raw_author_name":"Adriaan P. IJzerman","raw_affiliation_strings":["Division of Drug Discovery and Safety, Leiden Academic Centre for Drug Research, Leiden University, P.O. Box 9502, 2300 RA, Leiden, The Netherlands"],"affiliations":[{"raw_affiliation_string":"Division of Drug Discovery and Safety, Leiden Academic Centre for Drug Research, Leiden University, P.O. Box 9502, 2300 RA, Leiden, The Netherlands","institution_ids":["https://openalex.org/I4210133171","https://openalex.org/I121797337"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5088996741","display_name":"Gerard J. P. van Westen","orcid":"https://orcid.org/0000-0003-0717-1817"},"institutions":[{"id":"https://openalex.org/I121797337","display_name":"Leiden University","ror":"https://ror.org/027bh9e22","country_code":"NL","type":"education","lineage":["https://openalex.org/I121797337"]},{"id":"https://openalex.org/I4210133171","display_name":"Centre for Human Drug Research","ror":"https://ror.org/044hshx49","country_code":"NL","type":"facility","lineage":["https://openalex.org/I4210133171"]}],"countries":["NL"],"is_corresponding":true,"raw_author_name":"Gerard J. P. van Westen","raw_affiliation_strings":["Division of Drug Discovery and Safety, Leiden Academic Centre for Drug Research, Leiden University, P.O. Box 9502, 2300 RA, Leiden, The Netherlands"],"affiliations":[{"raw_affiliation_string":"Division of Drug Discovery and Safety, Leiden Academic Centre for Drug Research, Leiden University, P.O. Box 9502, 2300 RA, Leiden, The Netherlands","institution_ids":["https://openalex.org/I4210133171","https://openalex.org/I121797337"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5057416678","display_name":"Andrea Volkamer","orcid":null},"institutions":[{"id":"https://openalex.org/I7877124","display_name":"Charit\u00e9 - Universit\u00e4tsmedizin Berlin","ror":"https://ror.org/001w7jn25","country_code":"DE","type":"healthcare","lineage":["https://openalex.org/I7877124"]}],"countries":["DE"],"is_corresponding":true,"raw_author_name":"Andrea Volkamer","raw_affiliation_strings":["In silico Toxicology, Institute of Physiology, Charit\u00e9 \u2212 Universit\u00e4tsmedizin Berlin, Charit\u00e9platz 1, 10117 Berlin, Germany"],"affiliations":[{"raw_affiliation_string":"In silico Toxicology, Institute of Physiology, Charit\u00e9 \u2212 Universit\u00e4tsmedizin Berlin, Charit\u00e9platz 1, 10117 Berlin, Germany","institution_ids":["https://openalex.org/I7877124"]}]}],"institutions":[],"countries_distinct_count":3,"institutions_distinct_count":7,"corresponding_author_ids":["https://openalex.org/A5057416678","https://openalex.org/A5088996741"],"corresponding_institution_ids":["https://openalex.org/I121797337","https://openalex.org/I4210133171","https://openalex.org/I7877124"],"apc_list":null,"apc_paid":null,"fwci":15.1973,"has_fulltext":false,"cited_by_count":127,"citation_normalized_percentile":{"value":0.99265195,"is_in_top_1_percent":true,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":97,"max":100},"biblio":{"volume":"59","issue":"5","first_page":"1728","last_page":"1742"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.998199999332428,"subfield":{"id":"https://openalex.org/subfields/1703","display_name":"Computational Theory and Mathematics"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.998199999332428,"subfield":{"id":"https://openalex.org/subfields/1703","display_name":"Computational Theory and Mathematics"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T12254","display_name":"Machine Learning in Bioinformatics","score":0.9933000206947327,"subfield":{"id":"https://openalex.org/subfields/1312","display_name":"Molecular Biology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T10836","display_name":"Metabolomics and Mass Spectrometry Studies","score":0.989799976348877,"subfield":{"id":"https://openalex.org/subfields/1312","display_name":"Molecular Biology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.47960031032562256},{"id":"https://openalex.org/keywords/artificial-intelligence","display_name":"Artificial intelligence","score":0.3412349224090576},{"id":"https://openalex.org/keywords/data-science","display_name":"Data science","score":0.32352471351623535}],"concepts":[{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.47960031032562256},{"id":"https://openalex.org/C154945302","wikidata":"https://www.wikidata.org/wiki/Q11660","display_name":"Artificial intelligence","level":1,"score":0.3412349224090576},{"id":"https://openalex.org/C2522767166","wikidata":"https://www.wikidata.org/wiki/Q2374463","display_name":"Data science","level":1,"score":0.32352471351623535}],"mesh":[{"descriptor_ui":"D000069550","descriptor_name":"Machine Learning","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000069550","descriptor_name":"Machine Learning","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000069550","descriptor_name":"Machine Learning","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000818","descriptor_name":"Animals","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000818","descriptor_name":"Animals","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000818","descriptor_name":"Animals","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008024","descriptor_name":"Ligands","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008024","descriptor_name":"Ligands","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008024","descriptor_name":"Ligands","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011506","descriptor_name":"Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D011506","descriptor_name":"Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D011506","descriptor_name":"Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D015195","descriptor_name":"Drug Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D015195","descriptor_name":"Drug Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D015195","descriptor_name":"Drug Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D055808","descriptor_name":"Drug Discovery","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":false},{"descriptor_ui":"D055808","descriptor_name":"Drug Discovery","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":false},{"descriptor_ui":"D055808","descriptor_name":"Drug Discovery","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":false},{"descriptor_ui":"D058492","descriptor_name":"Drug Repositioning","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":false},{"descriptor_ui":"D058492","descriptor_name":"Drug Repositioning","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":false},{"descriptor_ui":"D058492","descriptor_name":"Drug Repositioning","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":false},{"descriptor_ui":"D060066","descriptor_name":"Protein Interaction Maps","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":false},{"descriptor_ui":"D060066","descriptor_name":"Protein Interaction Maps","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":false},{"descriptor_ui":"D060066","descriptor_name":"Protein Interaction Maps","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":false},{"descriptor_ui":"D064798","descriptor_name":"Polypharmacology","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D064798","descriptor_name":"Polypharmacology","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D064798","descriptor_name":"Polypharmacology","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false}],"locations_count":4,"locations":[{"id":"doi:10.1021/acs.jcim.8b00832","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jcim.8b00832","pdf_url":null,"source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},{"id":"pmid:30817146","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/30817146","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of chemical information and modeling","raw_type":null},{"id":"pmh:oai:scholarlypublications.universiteitleiden.nl:item_2911114","is_oa":true,"landing_page_url":"https://pubs.acs.org/doi/10.1021/acs.jcim.8b00832","pdf_url":"https://hdl.handle.net/1887/77053","source":{"id":"https://openalex.org/S4306400850","display_name":"Leiden Repository (Leiden University)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I121797337","host_organization_name":"Leiden University","host_organization_lineage":["https://openalex.org/I121797337"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"Article / Letter to editor"},{"id":"pmh:oai:openaccess.leidenuniv.nl:1887/77053","is_oa":false,"landing_page_url":"http://hdl.handle.net/1887/77053","pdf_url":null,"source":{"id":"https://openalex.org/S4306400850","display_name":"Leiden Repository (Leiden University)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I121797337","host_organization_name":"Leiden University","host_organization_lineage":["https://openalex.org/I121797337"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"https://pubs.acs.org/doi/10.1021/acs.jcim.8b00832","raw_type":"Article / Letter to editor"}],"best_oa_location":{"id":"pmh:oai:scholarlypublications.universiteitleiden.nl:item_2911114","is_oa":true,"landing_page_url":"https://pubs.acs.org/doi/10.1021/acs.jcim.8b00832","pdf_url":"https://hdl.handle.net/1887/77053","source":{"id":"https://openalex.org/S4306400850","display_name":"Leiden Repository (Leiden University)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I121797337","host_organization_name":"Leiden University","host_organization_lineage":["https://openalex.org/I121797337"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"Article / Letter to editor"},"sustainable_development_goals":[{"score":0.6200000047683716,"display_name":"Good health and well-being","id":"https://metadata.un.org/sdg/3"}],"awards":[{"id":"https://openalex.org/G7164716608","display_name":null,"funder_award_id":"VO 2353/1-1","funder_id":"https://openalex.org/F4320320879","funder_display_name":"Deutsche Forschungsgemeinschaft"},{"id":"https://openalex.org/G7349063869","display_name":null,"funder_award_id":"031A262C","funder_id":"https://openalex.org/F4320321114","funder_display_name":"Bundesministerium f\u00fcr Bildung und Forschung"},{"id":"https://openalex.org/G7608991046","display_name":null,"funder_award_id":"14410","funder_id":"https://openalex.org/F4320334893","funder_display_name":"Stichting voor de Technische Wetenschappen"}],"funders":[{"id":"https://openalex.org/F4320320879","display_name":"Deutsche Forschungsgemeinschaft","ror":"https://ror.org/018mejw64"},{"id":"https://openalex.org/F4320321114","display_name":"Bundesministerium f\u00fcr Bildung und Forschung","ror":"https://ror.org/04pz7b180"},{"id":"https://openalex.org/F4320321800","display_name":"Nederlandse Organisatie voor Wetenschappelijk Onderzoek","ror":"https://ror.org/04jsz6e67"},{"id":"https://openalex.org/F4320334893","display_name":"Stichting voor de Technische Wetenschappen","ror":"https://ror.org/057tq3593"}],"has_content":{"pdf":true,"grobid_xml":false},"content_urls":{"pdf":"https://content.openalex.org/works/W2920735258.pdf"},"referenced_works_count":129,"referenced_works":["https://openalex.org/W959778778","https://openalex.org/W1488838306","https://openalex.org/W1550214637","https://openalex.org/W1595350250","https://openalex.org/W1688073391","https://openalex.org/W1789172747","https://openalex.org/W1800166884","https://openalex.org/W1869829652","https://openalex.org/W1963538288","https://openalex.org/W1967032556","https://openalex.org/W1969657447","https://openalex.org/W1971106435","https://openalex.org/W1971213794","https://openalex.org/W1972650279","https://openalex.org/W1974166884","https://openalex.org/W1975147762","https://openalex.org/W1978253274","https://openalex.org/W1980047995","https://openalex.org/W1980969309","https://openalex.org/W1981433258","https://openalex.org/W1982131304","https://openalex.org/W1982885147","https://openalex.org/W1983478747","https://openalex.org/W1985748743","https://openalex.org/W1988037271","https://openalex.org/W1988195734","https://openalex.org/W1989713570","https://openalex.org/W1993085040","https://openalex.org/W1993554808","https://openalex.org/W1995530068","https://openalex.org/W1997655258","https://openalex.org/W1999289321","https://openalex.org/W2000077914","https://openalex.org/W2002278080","https://openalex.org/W2003364609","https://openalex.org/W2004629718","https://openalex.org/W2013701719","https://openalex.org/W2019523557","https://openalex.org/W2019678805","https://openalex.org/W2021954541","https://openalex.org/W2022333844","https://openalex.org/W2023327385","https://openalex.org/W2024213882","https://openalex.org/W2024391534","https://openalex.org/W2032676191","https://openalex.org/W2034042429","https://openalex.org/W2040135138","https://openalex.org/W2040595595","https://openalex.org/W2041203323","https://openalex.org/W2041877730","https://openalex.org/W2045671967","https://openalex.org/W2051673012","https://openalex.org/W2055043387","https://openalex.org/W2055147198","https://openalex.org/W2059074749","https://openalex.org/W2062941476","https://openalex.org/W2070789802","https://openalex.org/W2074061743","https://openalex.org/W2076257979","https://openalex.org/W2078653892","https://openalex.org/W2080754816","https://openalex.org/W2086380285","https://openalex.org/W2088970363","https://openalex.org/W2089589794","https://openalex.org/W2094356718","https://openalex.org/W2096021562","https://openalex.org/W2096039340","https://openalex.org/W2096541451","https://openalex.org/W2100076566","https://openalex.org/W2104871495","https://openalex.org/W2111385909","https://openalex.org/W2112411768","https://openalex.org/W2113494611","https://openalex.org/W2116623522","https://openalex.org/W2121604817","https://openalex.org/W2127067710","https://openalex.org/W2130479394","https://openalex.org/W2131272506","https://openalex.org/W2131724426","https://openalex.org/W2135683724","https://openalex.org/W2137507165","https://openalex.org/W2138512826","https://openalex.org/W2138770756","https://openalex.org/W2143482176","https://openalex.org/W2146940292","https://openalex.org/W2147561069","https://openalex.org/W2153251136","https://openalex.org/W2153838454","https://openalex.org/W2154480514","https://openalex.org/W2158714788","https://openalex.org/W2162011385","https://openalex.org/W2168938595","https://openalex.org/W2170146596","https://openalex.org/W2177317049","https://openalex.org/W2196714401","https://openalex.org/W2272547341","https://openalex.org/W2316533333","https://openalex.org/W2320034101","https://openalex.org/W2320259278","https://openalex.org/W2322633051","https://openalex.org/W2398789413","https://openalex.org/W2402506318","https://openalex.org/W2416046665","https://openalex.org/W2508733374","https://openalex.org/W2518384400","https://openalex.org/W2521095856","https://openalex.org/W2524653815","https://openalex.org/W2593632281","https://openalex.org/W2594183968","https://openalex.org/W2611425558","https://openalex.org/W2612467560","https://openalex.org/W2621737540","https://openalex.org/W2724676775","https://openalex.org/W2733454913","https://openalex.org/W2737918162","https://openalex.org/W2740946158","https://openalex.org/W2745395435","https://openalex.org/W2749782473","https://openalex.org/W2770865754","https://openalex.org/W2793534579","https://openalex.org/W2794301983","https://openalex.org/W2800222455","https://openalex.org/W2802492120","https://openalex.org/W2803098868","https://openalex.org/W2806547269","https://openalex.org/W2886036738","https://openalex.org/W2900167333","https://openalex.org/W2901476322","https://openalex.org/W4252412917"],"related_works":["https://openalex.org/W4391375266","https://openalex.org/W2748952813","https://openalex.org/W2390279801","https://openalex.org/W2358668433","https://openalex.org/W4396701345","https://openalex.org/W2376932109","https://openalex.org/W2001405890","https://openalex.org/W4396696052","https://openalex.org/W2382290278","https://openalex.org/W4395014643"],"abstract_inverted_index":{"Target":[0],"deconvolution":[1],"is":[2,23],"a":[3,41,66],"vital":[4],"initial":[5],"step":[6],"in":[7],"preclinical":[8],"drug":[9,61],"development":[10],"to":[11,25,40,60],"determine":[12],"research":[13],"focus":[14],"and":[15,71,86],"strategy.":[16],"In":[17],"this":[18],"respect,":[19],"computational":[20,79],"target":[21,80],"prediction":[22],"used":[24],"identify":[26],"the":[27,36,48,52],"most":[28,37],"probable":[29],"targets":[30,39],"of":[31,51],"an":[32],"orphan":[33],"ligand":[34],"or":[35,56],"similar":[38],"protein":[42],"under":[43],"investigation.":[44],"Applications":[45],"range":[46],"from":[47],"fundamental":[49],"analysis":[50],"mode-of-action":[53],"over":[54],"polypharmacology":[55],"adverse":[57],"effect":[58],"predictions":[59],"repositioning.":[62],"Here,":[63],"we":[64],"provide":[65],"review":[67],"on":[68],"published":[69],"ligand-":[70],"target-based":[72],"as":[73,75],"well":[74],"hybrid":[76],"approaches":[77],"for":[78],"prediction,":[81],"together":[82],"with":[83],"current":[84],"limitations":[85],"future":[87],"directions.":[88]},"counts_by_year":[{"year":2026,"cited_by_count":4},{"year":2025,"cited_by_count":9},{"year":2024,"cited_by_count":25},{"year":2023,"cited_by_count":13},{"year":2022,"cited_by_count":21},{"year":2021,"cited_by_count":24},{"year":2020,"cited_by_count":27},{"year":2019,"cited_by_count":4}],"updated_date":"2026-04-09T08:11:56.329763","created_date":"2025-10-10T00:00:00"}