{"id":"https://openalex.org/W4408280008","doi":"https://doi.org/10.1186/s13321-025-00963-z","title":"Fifteen years of ChEMBL and its role in cheminformatics and drug discovery","display_name":"Fifteen years of ChEMBL and its role in cheminformatics and drug discovery","publication_year":2025,"publication_date":"2025-03-10","ids":{"openalex":"https://openalex.org/W4408280008","doi":"https://doi.org/10.1186/s13321-025-00963-z","pmid":"https://pubmed.ncbi.nlm.nih.gov/40065463"},"language":"en","primary_location":{"id":"doi:10.1186/s13321-025-00963-z","is_oa":true,"landing_page_url":"https://doi.org/10.1186/s13321-025-00963-z","pdf_url":"https://jcheminf.biomedcentral.com/counter/pdf/10.1186/s13321-025-00963-z","source":{"id":"https://openalex.org/S180838163","display_name":"Journal of Cheminformatics","issn_l":"1758-2946","issn":["1758-2946"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310320256","host_organization_name":"BioMed Central","host_organization_lineage":["https://openalex.org/P4310320256","https://openalex.org/P4310319965"],"host_organization_lineage_names":["BioMed Central","Springer Nature"],"type":"journal"},"license":"cc-by-nc-nd","license_id":"https://openalex.org/licenses/cc-by-nc-nd","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Cheminformatics","raw_type":"journal-article"},"type":"review","indexed_in":["crossref","doaj","pubmed"],"open_access":{"is_oa":true,"oa_status":"gold","oa_url":"https://jcheminf.biomedcentral.com/counter/pdf/10.1186/s13321-025-00963-z","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5053048742","display_name":"Barbara Zdrazil","orcid":"https://orcid.org/0000-0001-9395-1515"},"institutions":[{"id":"https://openalex.org/I1303153112","display_name":"European Bioinformatics Institute","ror":"https://ror.org/02catss52","country_code":"GB","type":"facility","lineage":["https://openalex.org/I1303153112","https://openalex.org/I4210138560"]}],"countries":["GB"],"is_corresponding":true,"raw_author_name":"Barbara Zdrazil","raw_affiliation_strings":["European Molecular Biology Laboratory, European Bioinformatics Institute (EMBL-EBI), Wellcome Genome Campus, Hinxton, Cambridgeshire, CB101SD, UK. bzdrazil@ebi.ac.uk","European Molecular Biology Laboratory, European Bioinformatics Institute (EMBL-EBI), Wellcome Genome Campus, Hinxton, Cambridgeshire, CB101SD, UK"],"affiliations":[{"raw_affiliation_string":"European Molecular Biology Laboratory, European Bioinformatics Institute (EMBL-EBI), Wellcome Genome Campus, Hinxton, Cambridgeshire, CB101SD, UK. bzdrazil@ebi.ac.uk","institution_ids":["https://openalex.org/I1303153112"]},{"raw_affiliation_string":"European Molecular Biology Laboratory, European Bioinformatics Institute (EMBL-EBI), Wellcome Genome Campus, Hinxton, Cambridgeshire, CB101SD, UK","institution_ids":["https://openalex.org/I1303153112"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5053048742"],"corresponding_institution_ids":["https://openalex.org/I1303153112"],"apc_list":{"value":1290,"currency":"GBP","value_usd":1582},"apc_paid":{"value":1290,"currency":"GBP","value_usd":1582},"fwci":43.9269,"has_fulltext":false,"cited_by_count":33,"citation_normalized_percentile":{"value":0.99839462,"is_in_top_1_percent":true,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":99,"max":100},"biblio":{"volume":"17","issue":"1","first_page":"32","last_page":"32"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.9997000098228455,"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":0.9997000098228455,"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/T13937","display_name":"Genetics, Bioinformatics, and Biomedical Research","score":0.964900016784668,"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/T10375","display_name":"Pharmacogenetics and Drug Metabolism","score":0.9555000066757202,"subfield":{"id":"https://openalex.org/subfields/3004","display_name":"Pharmacology"},"field":{"id":"https://openalex.org/fields/30","display_name":"Pharmacology, Toxicology and Pharmaceutics"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/chembl","display_name":"chEMBL","score":0.966515839099884},{"id":"https://openalex.org/keywords/cheminformatics","display_name":"Cheminformatics","score":0.9263619780540466},{"id":"https://openalex.org/keywords/drug-discovery","display_name":"Drug discovery","score":0.7054567933082581},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.5492704510688782},{"id":"https://openalex.org/keywords/data-science","display_name":"Data science","score":0.4963989853858948},{"id":"https://openalex.org/keywords/world-wide-web","display_name":"World Wide Web","score":0.33156049251556396},{"id":"https://openalex.org/keywords/bioinformatics","display_name":"Bioinformatics","score":0.2742050290107727},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.1092633605003357}],"concepts":[{"id":"https://openalex.org/C63222358","wikidata":"https://www.wikidata.org/wiki/Q6120337","display_name":"chEMBL","level":3,"score":0.966515839099884},{"id":"https://openalex.org/C68762167","wikidata":"https://www.wikidata.org/wiki/Q910164","display_name":"Cheminformatics","level":2,"score":0.9263619780540466},{"id":"https://openalex.org/C74187038","wikidata":"https://www.wikidata.org/wiki/Q1418791","display_name":"Drug discovery","level":2,"score":0.7054567933082581},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.5492704510688782},{"id":"https://openalex.org/C2522767166","wikidata":"https://www.wikidata.org/wiki/Q2374463","display_name":"Data science","level":1,"score":0.4963989853858948},{"id":"https://openalex.org/C136764020","wikidata":"https://www.wikidata.org/wiki/Q466","display_name":"World Wide Web","level":1,"score":0.33156049251556396},{"id":"https://openalex.org/C60644358","wikidata":"https://www.wikidata.org/wiki/Q128570","display_name":"Bioinformatics","level":1,"score":0.2742050290107727},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.1092633605003357}],"mesh":[],"locations_count":4,"locations":[{"id":"doi:10.1186/s13321-025-00963-z","is_oa":true,"landing_page_url":"https://doi.org/10.1186/s13321-025-00963-z","pdf_url":"https://jcheminf.biomedcentral.com/counter/pdf/10.1186/s13321-025-00963-z","source":{"id":"https://openalex.org/S180838163","display_name":"Journal of Cheminformatics","issn_l":"1758-2946","issn":["1758-2946"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310320256","host_organization_name":"BioMed Central","host_organization_lineage":["https://openalex.org/P4310320256","https://openalex.org/P4310319965"],"host_organization_lineage_names":["BioMed Central","Springer Nature"],"type":"journal"},"license":"cc-by-nc-nd","license_id":"https://openalex.org/licenses/cc-by-nc-nd","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Cheminformatics","raw_type":"journal-article"},{"id":"pmid:40065463","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/40065463","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 cheminformatics","raw_type":null},{"id":"pmh:oai:doaj.org/article:9b9afd4f8fc047158a80bbb519dd62e4","is_oa":true,"landing_page_url":"https://doaj.org/article/9b9afd4f8fc047158a80bbb519dd62e4","pdf_url":null,"source":{"id":"https://openalex.org/S112646816","display_name":"SHILAP Revista de lepidopterolog\u00eda","issn_l":"0300-5267","issn":["0300-5267","2340-4078"],"is_oa":true,"is_in_doaj":true,"is_core":false,"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Journal of Cheminformatics, Vol 17, Iss 1, Pp 1-9 (2025)","raw_type":"article"},{"id":"pmh:oai:pubmedcentral.nih.gov:11895189","is_oa":true,"landing_page_url":"https://www.ncbi.nlm.nih.gov/pmc/articles/11895189","pdf_url":null,"source":{"id":"https://openalex.org/S2764455111","display_name":"PubMed Central","issn_l":null,"issn":null,"is_oa":true,"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":"other-oa","license_id":"https://openalex.org/licenses/other-oa","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"J Cheminform","raw_type":"Text"}],"best_oa_location":{"id":"doi:10.1186/s13321-025-00963-z","is_oa":true,"landing_page_url":"https://doi.org/10.1186/s13321-025-00963-z","pdf_url":"https://jcheminf.biomedcentral.com/counter/pdf/10.1186/s13321-025-00963-z","source":{"id":"https://openalex.org/S180838163","display_name":"Journal of Cheminformatics","issn_l":"1758-2946","issn":["1758-2946"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310320256","host_organization_name":"BioMed Central","host_organization_lineage":["https://openalex.org/P4310320256","https://openalex.org/P4310319965"],"host_organization_lineage_names":["BioMed Central","Springer Nature"],"type":"journal"},"license":"cc-by-nc-nd","license_id":"https://openalex.org/licenses/cc-by-nc-nd","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Cheminformatics","raw_type":"journal-article"},"sustainable_development_goals":[],"awards":[],"funders":[{"id":"https://openalex.org/F4320314023","display_name":"European Molecular Biology Laboratory","ror":"https://ror.org/050589e39"}],"has_content":{"grobid_xml":false,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W4408280008.pdf"},"referenced_works_count":48,"referenced_works":["https://openalex.org/W1185153672","https://openalex.org/W1869829652","https://openalex.org/W1972773608","https://openalex.org/W2005858009","https://openalex.org/W2010933199","https://openalex.org/W2045673749","https://openalex.org/W2069380892","https://openalex.org/W2072582769","https://openalex.org/W2076018790","https://openalex.org/W2076900316","https://openalex.org/W2094400680","https://openalex.org/W2096541451","https://openalex.org/W2099536383","https://openalex.org/W2151338484","https://openalex.org/W2472085920","https://openalex.org/W2593450356","https://openalex.org/W2740946158","https://openalex.org/W2805978167","https://openalex.org/W2815914914","https://openalex.org/W2895947066","https://openalex.org/W2896252085","https://openalex.org/W2899196579","https://openalex.org/W2905261310","https://openalex.org/W2909055772","https://openalex.org/W2909827435","https://openalex.org/W2997728144","https://openalex.org/W3014830278","https://openalex.org/W3091833444","https://openalex.org/W3093594696","https://openalex.org/W3123007855","https://openalex.org/W3204734866","https://openalex.org/W4200159290","https://openalex.org/W4220791160","https://openalex.org/W4283728533","https://openalex.org/W4287307915","https://openalex.org/W4294607412","https://openalex.org/W4307468223","https://openalex.org/W4313503466","https://openalex.org/W4367853754","https://openalex.org/W4388455891","https://openalex.org/W4391325212","https://openalex.org/W4402067304","https://openalex.org/W4404062740","https://openalex.org/W4404437109","https://openalex.org/W4404865467","https://openalex.org/W4404914012","https://openalex.org/W4404974486","https://openalex.org/W4405474866"],"related_works":["https://openalex.org/W2780675302","https://openalex.org/W4294024451","https://openalex.org/W2477626301","https://openalex.org/W4207063555","https://openalex.org/W4408280008","https://openalex.org/W2585302987","https://openalex.org/W2477820794","https://openalex.org/W4402084195","https://openalex.org/W1964657534","https://openalex.org/W2472085920"],"abstract_inverted_index":{"In":[0],"October":[1],"2024":[2],"we":[3],"celebrated":[4],"the":[5,9,38,80,90],"15th":[6],"anniversary":[7],"of":[8,12],"first":[10],"launch":[11],"ChEMBL,":[13],"Europe's":[14],"most":[15],"impactful,":[16],"open-access":[17],"drug":[18],"discovery":[19],"database,":[20],"hosted":[21],"by":[22,61],"EMBL's":[23],"European":[24,91],"Bioinformatics":[25],"Institute":[26],"(EMBL-EBI).":[27],"This":[28],"is":[29],"a":[30],"good":[31],"moment":[32],"to":[33,70,73,78],"reflect":[34],"on":[35,89],"ChEMBL's":[36],"history,":[37],"role":[39],"that":[40,68,75],"ChEMBL":[41,76],"plays":[42],"in":[43],"Cheminformatics":[44],"and":[45,65,93],"Drug":[46],"Discovery":[47],"as":[48,50],"well":[49],"innovations":[51],"accelerated":[52],"using":[53],"data":[54,88],"extracted":[55],"from":[56],"it.":[57],"The":[58],"review":[59],"closes":[60],"discussing":[62],"current":[63],"challenges":[64],"possible":[66],"directions":[67],"need":[69],"be":[71,79],"taken":[72],"guarantee":[74],"continues":[77],"pioneering":[81],"resource":[82],"for":[83],"highly":[84],"curated,":[85],"open":[86],"bioactivity":[87],"continent":[92],"beyond.":[94]},"counts_by_year":[{"year":2026,"cited_by_count":16},{"year":2025,"cited_by_count":17}],"updated_date":"2026-04-23T09:07:50.710637","created_date":"2025-10-10T00:00:00"}
