{"id":"https://openalex.org/W2040609223","doi":"https://doi.org/10.1007/s10822-005-1778-x","title":"Understanding and modulating cyclin-dependent kinase inhibitor specificity: molecular modeling and biochemical evaluation of pyrazolopyrimidinones as CDK2/cyclin A and CDK4/cyclin D1 inhibitors","display_name":"Understanding and modulating cyclin-dependent kinase inhibitor specificity: molecular modeling and biochemical evaluation of pyrazolopyrimidinones as CDK2/cyclin A and CDK4/cyclin D1 inhibitors","publication_year":2005,"publication_date":"2005-02-01","ids":{"openalex":"https://openalex.org/W2040609223","doi":"https://doi.org/10.1007/s10822-005-1778-x","mag":"2040609223","pmid":"https://pubmed.ncbi.nlm.nih.gov/16075305"},"language":"en","primary_location":{"id":"doi:10.1007/s10822-005-1778-x","is_oa":false,"landing_page_url":"https://doi.org/10.1007/s10822-005-1778-x","pdf_url":null,"source":{"id":"https://openalex.org/S64621741","display_name":"Journal of Computer-Aided Molecular Design","issn_l":"0920-654X","issn":["0920-654X","1573-4951"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310319900","host_organization_name":"Springer Science+Business Media","host_organization_lineage":["https://openalex.org/P4310319900","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Springer Science+Business Media","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Computer-Aided Molecular Design","raw_type":"journal-article"},"type":"article","indexed_in":["crossref","pubmed"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5054179990","display_name":"Karen A. Rossi","orcid":null},"institutions":[{"id":"https://openalex.org/I157075465","display_name":"Bristol-Myers Squibb (Germany)","ror":"https://ror.org/032hfv632","country_code":"DE","type":"company","lineage":["https://openalex.org/I157075465","https://openalex.org/I4210091812"]},{"id":"https://openalex.org/I4210091812","display_name":"Bristol-Myers Squibb (United States)","ror":"https://ror.org/00gtmwv55","country_code":"US","type":"company","lineage":["https://openalex.org/I4210091812"]},{"id":"https://openalex.org/I4210148404","display_name":"Bristol-Myers Squibb (Japan)","ror":"https://ror.org/04dbmrm19","country_code":"JP","type":"company","lineage":["https://openalex.org/I4210091812","https://openalex.org/I4210148404"]}],"countries":["DE","JP","US"],"is_corresponding":true,"raw_author_name":"Karen A. Rossi","raw_affiliation_strings":["Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton, NJ 08543, USA. karen.rossi@bms.com","Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton, NJ 08543, USA. karen.rossi@bms.com","institution_ids":["https://openalex.org/I157075465","https://openalex.org/I4210091812","https://openalex.org/I4210148404"]},{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA","institution_ids":["https://openalex.org/I4210091812"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5035946430","display_name":"Jay A. Markwalder","orcid":null},"institutions":[{"id":"https://openalex.org/I4210091812","display_name":"Bristol-Myers Squibb (United States)","ror":"https://ror.org/00gtmwv55","country_code":"US","type":"company","lineage":["https://openalex.org/I4210091812"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Jay A. Markwalder","raw_affiliation_strings":["Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton NJ, 08543, USA","Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton NJ, 08543, USA","institution_ids":["https://openalex.org/I4210091812"]},{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA","institution_ids":["https://openalex.org/I4210091812"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5090942677","display_name":"Steven P. Seitz","orcid":"https://orcid.org/0000-0002-4119-3035"},"institutions":[{"id":"https://openalex.org/I4210091812","display_name":"Bristol-Myers Squibb (United States)","ror":"https://ror.org/00gtmwv55","country_code":"US","type":"company","lineage":["https://openalex.org/I4210091812"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Steven P. Seitz","raw_affiliation_strings":["Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton NJ, 08543, USA","Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton NJ, 08543, USA","institution_ids":["https://openalex.org/I4210091812"]},{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA","institution_ids":["https://openalex.org/I4210091812"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5013836093","display_name":"Chong\u2010Hwan Chang","orcid":null},"institutions":[{"id":"https://openalex.org/I4210091812","display_name":"Bristol-Myers Squibb (United States)","ror":"https://ror.org/00gtmwv55","country_code":"US","type":"company","lineage":["https://openalex.org/I4210091812"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Chong-Hwan Chang","raw_affiliation_strings":["Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton NJ, 08543, USA","Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton NJ, 08543, USA","institution_ids":["https://openalex.org/I4210091812"]},{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA","institution_ids":["https://openalex.org/I4210091812"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5020140046","display_name":"Sarah Cox","orcid":"https://orcid.org/0000-0001-9982-3987"},"institutions":[{"id":"https://openalex.org/I4210091812","display_name":"Bristol-Myers Squibb (United States)","ror":"https://ror.org/00gtmwv55","country_code":"US","type":"company","lineage":["https://openalex.org/I4210091812"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Sarah Cox","raw_affiliation_strings":["Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton NJ, 08543, USA","Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton NJ, 08543, USA","institution_ids":["https://openalex.org/I4210091812"]},{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA","institution_ids":["https://openalex.org/I4210091812"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5113533612","display_name":"Michael D. Boisclair","orcid":null},"institutions":[{"id":"https://openalex.org/I177340980","display_name":"Farmingdale State College","ror":"https://ror.org/010thz337","country_code":"US","type":"education","lineage":["https://openalex.org/I177340980"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Michael D. Boisclair","raw_affiliation_strings":["OSI Pharmaceuticals, 1 Bioscience Park Drive, Farmingdale, NY, 11735, USA","OSI Pharmaceuticals, Farmingdale, NY, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"OSI Pharmaceuticals, 1 Bioscience Park Drive, Farmingdale, NY, 11735, USA","institution_ids":[]},{"raw_affiliation_string":"OSI Pharmaceuticals, Farmingdale, NY, USA","institution_ids":["https://openalex.org/I177340980"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5054142100","display_name":"Leonardo Brizuela","orcid":null},"institutions":[{"id":"https://openalex.org/I136199984","display_name":"Harvard University","ror":"https://ror.org/03vek6s52","country_code":"US","type":"education","lineage":["https://openalex.org/I136199984"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Leonardo Brizuela","raw_affiliation_strings":["Department of BCMP, Harvard Medical School, 240 Longwood Ave., SGM. Room 211, Boston, MA, 02115, USA","Department of BCMP, Harvard Medical School, Boston, MA, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of BCMP, Harvard Medical School, 240 Longwood Ave., SGM. Room 211, Boston, MA, 02115, USA","institution_ids":["https://openalex.org/I136199984"]},{"raw_affiliation_string":"Department of BCMP, Harvard Medical School, Boston, MA, USA","institution_ids":["https://openalex.org/I136199984"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5073493703","display_name":"Stephen L. Brenner","orcid":null},"institutions":[{"id":"https://openalex.org/I4210091812","display_name":"Bristol-Myers Squibb (United States)","ror":"https://ror.org/00gtmwv55","country_code":"US","type":"company","lineage":["https://openalex.org/I4210091812"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Stephen L. Brenner","raw_affiliation_strings":["Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton NJ, 08543, USA","Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, 5400, Princeton NJ, 08543, USA","institution_ids":["https://openalex.org/I4210091812"]},{"raw_affiliation_string":"Pharmaceutical Research Institute, Bristol-Myers Squibb Company, Princeton NJ, USA","institution_ids":["https://openalex.org/I4210091812"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5080879196","display_name":"Pieter F. W. Stouten","orcid":"https://orcid.org/0000-0002-5203-2202"},"institutions":[{"id":"https://openalex.org/I4210127540","display_name":"Nerviano Medical Sciences","ror":"https://ror.org/038mzt421","country_code":"IT","type":"company","lineage":["https://openalex.org/I4210127540"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Pieter F. W. Stouten","raw_affiliation_strings":["Nerviano Medical Sciences, Viale Pasteur 10, 20014, Nerviano (MI), Italy","Nerviano Medical Sciences, Nerviano (MI), Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Nerviano Medical Sciences, Viale Pasteur 10, 20014, Nerviano (MI), Italy","institution_ids":["https://openalex.org/I4210127540"]},{"raw_affiliation_string":"Nerviano Medical Sciences, Nerviano (MI), Italy","institution_ids":["https://openalex.org/I4210127540"]}]}],"institutions":[],"countries_distinct_count":4,"institutions_distinct_count":6,"corresponding_author_ids":["https://openalex.org/A5054179990"],"corresponding_institution_ids":["https://openalex.org/I157075465","https://openalex.org/I4210091812","https://openalex.org/I4210148404"],"apc_list":{"value":3690,"currency":"USD","value_usd":3690},"apc_paid":null,"fwci":0.1377,"has_fulltext":false,"cited_by_count":13,"citation_normalized_percentile":{"value":0.50986487,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":89,"max":96},"biblio":{"volume":"19","issue":"2","first_page":"111","last_page":"122"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10583","display_name":"Cancer-related Molecular Pathways","score":0.9991999864578247,"subfield":{"id":"https://openalex.org/subfields/2730","display_name":"Oncology"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},"topics":[{"id":"https://openalex.org/T10583","display_name":"Cancer-related Molecular Pathways","score":0.9991999864578247,"subfield":{"id":"https://openalex.org/subfields/2730","display_name":"Oncology"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},{"id":"https://openalex.org/T10492","display_name":"Microtubule and mitosis dynamics","score":0.9858999848365784,"subfield":{"id":"https://openalex.org/subfields/1307","display_name":"Cell 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/T12829","display_name":"Advanced Breast Cancer Therapies","score":0.9853000044822693,"subfield":{"id":"https://openalex.org/subfields/2740","display_name":"Pulmonary and Respiratory Medicine"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/cyclin-dependent-kinase","display_name":"Cyclin-dependent kinase","score":0.9296208620071411},{"id":"https://openalex.org/keywords/cyclin-dependent-kinase-2","display_name":"Cyclin-dependent kinase 2","score":0.6708464622497559},{"id":"https://openalex.org/keywords/kinase","display_name":"Kinase","score":0.52157062292099},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.515487015247345},{"id":"https://openalex.org/keywords/cyclin-a","display_name":"Cyclin A","score":0.4991731643676758},{"id":"https://openalex.org/keywords/biochemistry","display_name":"Biochemistry","score":0.46430423855781555},{"id":"https://openalex.org/keywords/cyclin-d1","display_name":"Cyclin D1","score":0.44537264108657837},{"id":"https://openalex.org/keywords/cyclin","display_name":"Cyclin","score":0.4404495358467102},{"id":"https://openalex.org/keywords/cyclin-dependent-kinase-4","display_name":"Cyclin-dependent kinase 4","score":0.43506571650505066},{"id":"https://openalex.org/keywords/cell-cycle","display_name":"Cell cycle","score":0.41010504961013794},{"id":"https://openalex.org/keywords/cancer-research","display_name":"Cancer research","score":0.39939820766448975},{"id":"https://openalex.org/keywords/cell-biology","display_name":"Cell biology","score":0.38365867733955383},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.35315388441085815},{"id":"https://openalex.org/keywords/protein-kinase-a","display_name":"Protein kinase A","score":0.15982717275619507},{"id":"https://openalex.org/keywords/cell","display_name":"Cell","score":0.10966241359710693}],"concepts":[{"id":"https://openalex.org/C124320809","wikidata":"https://www.wikidata.org/wiki/Q46292","display_name":"Cyclin-dependent kinase","level":4,"score":0.9296208620071411},{"id":"https://openalex.org/C82495950","wikidata":"https://www.wikidata.org/wiki/Q14911732","display_name":"Cyclin-dependent kinase 2","level":4,"score":0.6708464622497559},{"id":"https://openalex.org/C184235292","wikidata":"https://www.wikidata.org/wiki/Q421851","display_name":"Kinase","level":2,"score":0.52157062292099},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.515487015247345},{"id":"https://openalex.org/C16438837","wikidata":"https://www.wikidata.org/wiki/Q5198260","display_name":"Cyclin A","level":5,"score":0.4991731643676758},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.46430423855781555},{"id":"https://openalex.org/C199835354","wikidata":"https://www.wikidata.org/wiki/Q15311861","display_name":"Cyclin D1","level":4,"score":0.44537264108657837},{"id":"https://openalex.org/C120089663","wikidata":"https://www.wikidata.org/wiki/Q59250999","display_name":"Cyclin","level":4,"score":0.4404495358467102},{"id":"https://openalex.org/C51853150","wikidata":"https://www.wikidata.org/wiki/Q14911754","display_name":"Cyclin-dependent kinase 4","level":5,"score":0.43506571650505066},{"id":"https://openalex.org/C29537977","wikidata":"https://www.wikidata.org/wiki/Q188941","display_name":"Cell cycle","level":3,"score":0.41010504961013794},{"id":"https://openalex.org/C502942594","wikidata":"https://www.wikidata.org/wiki/Q3421914","display_name":"Cancer research","level":1,"score":0.39939820766448975},{"id":"https://openalex.org/C95444343","wikidata":"https://www.wikidata.org/wiki/Q7141","display_name":"Cell biology","level":1,"score":0.38365867733955383},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.35315388441085815},{"id":"https://openalex.org/C97029542","wikidata":"https://www.wikidata.org/wiki/Q281417","display_name":"Protein kinase A","level":3,"score":0.15982717275619507},{"id":"https://openalex.org/C1491633281","wikidata":"https://www.wikidata.org/wiki/Q7868","display_name":"Cell","level":2,"score":0.10966241359710693}],"mesh":[{"descriptor_ui":"D000595","descriptor_name":"Amino Acid Sequence","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000595","descriptor_name":"Amino Acid Sequence","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000595","descriptor_name":"Amino Acid Sequence","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D004353","descriptor_name":"Drug Evaluation, Preclinical","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D004353","descriptor_name":"Drug Evaluation, Preclinical","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D004353","descriptor_name":"Drug Evaluation, Preclinical","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D004791","descriptor_name":"Enzyme Inhibitors","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D004791","descriptor_name":"Enzyme Inhibitors","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D004791","descriptor_name":"Enzyme Inhibitors","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D004791","descriptor_name":"Enzyme Inhibitors","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D004791","descriptor_name":"Enzyme Inhibitors","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D004791","descriptor_name":"Enzyme Inhibitors","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D006860","descriptor_name":"Hydrogen Bonding","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006860","descriptor_name":"Hydrogen Bonding","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006860","descriptor_name":"Hydrogen Bonding","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008969","descriptor_name":"Molecular Sequence Data","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008969","descriptor_name":"Molecular Sequence Data","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008969","descriptor_name":"Molecular Sequence Data","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011518","descriptor_name":"Proto-Oncogene Proteins","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D011518","descriptor_name":"Proto-Oncogene Proteins","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D011518","descriptor_name":"Proto-Oncogene Proteins","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D011518","descriptor_name":"Proto-Oncogene Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D011518","descriptor_name":"Proto-Oncogene Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D011518","descriptor_name":"Proto-Oncogene Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D011744","descriptor_name":"Pyrimidinones","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D011744","descriptor_name":"Pyrimidinones","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D011744","descriptor_name":"Pyrimidinones","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D011744","descriptor_name":"Pyrimidinones","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D011744","descriptor_name":"Pyrimidinones","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D011744","descriptor_name":"Pyrimidinones","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D013379","descriptor_name":"Substrate Specificity","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013379","descriptor_name":"Substrate Specificity","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013379","descriptor_name":"Substrate Specificity","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D017386","descriptor_name":"Sequence Homology, Amino Acid","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D017386","descriptor_name":"Sequence Homology, Amino Acid","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D017386","descriptor_name":"Sequence Homology, Amino Acid","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D018844","descriptor_name":"Cyclin-Dependent Kinases","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D018844","descriptor_name":"Cyclin-Dependent Kinases","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D018844","descriptor_name":"Cyclin-Dependent Kinases","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D018844","descriptor_name":"Cyclin-Dependent Kinases","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D018844","descriptor_name":"Cyclin-Dependent Kinases","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D018844","descriptor_name":"Cyclin-Dependent Kinases","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D019925","descriptor_name":"Cyclin A","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D019925","descriptor_name":"Cyclin A","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D019925","descriptor_name":"Cyclin A","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D019938","descriptor_name":"Cyclin D1","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D019938","descriptor_name":"Cyclin D1","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D019938","descriptor_name":"Cyclin D1","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D042846","descriptor_name":"CDC2-CDC28 Kinases","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D042846","descriptor_name":"CDC2-CDC28 Kinases","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D042846","descriptor_name":"CDC2-CDC28 Kinases","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D042846","descriptor_name":"CDC2-CDC28 Kinases","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D042846","descriptor_name":"CDC2-CDC28 Kinases","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D042846","descriptor_name":"CDC2-CDC28 Kinases","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D051357","descriptor_name":"Cyclin-Dependent Kinase 2","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D051357","descriptor_name":"Cyclin-Dependent Kinase 2","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D051357","descriptor_name":"Cyclin-Dependent Kinase 2","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D051358","descriptor_name":"Cyclin-Dependent Kinase 4","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D051358","descriptor_name":"Cyclin-Dependent Kinase 4","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D051358","descriptor_name":"Cyclin-Dependent Kinase 4","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false}],"locations_count":2,"locations":[{"id":"doi:10.1007/s10822-005-1778-x","is_oa":false,"landing_page_url":"https://doi.org/10.1007/s10822-005-1778-x","pdf_url":null,"source":{"id":"https://openalex.org/S64621741","display_name":"Journal of Computer-Aided Molecular Design","issn_l":"0920-654X","issn":["0920-654X","1573-4951"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310319900","host_organization_name":"Springer Science+Business Media","host_organization_lineage":["https://openalex.org/P4310319900","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Springer Science+Business Media","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Computer-Aided Molecular Design","raw_type":"journal-article"},{"id":"pmid:16075305","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/16075305","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 computer-aided molecular design","raw_type":null}],"best_oa_location":null,"sustainable_development_goals":[],"awards":[],"funders":[],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":31,"referenced_works":["https://openalex.org/W19309647","https://openalex.org/W1544512904","https://openalex.org/W1569698611","https://openalex.org/W1966041739","https://openalex.org/W1969939692","https://openalex.org/W1971140803","https://openalex.org/W1974391793","https://openalex.org/W1983348452","https://openalex.org/W1994949503","https://openalex.org/W1994968612","https://openalex.org/W1997080230","https://openalex.org/W2002184732","https://openalex.org/W2004563114","https://openalex.org/W2021505095","https://openalex.org/W2024243556","https://openalex.org/W2027558915","https://openalex.org/W2032234728","https://openalex.org/W2032236714","https://openalex.org/W2036034114","https://openalex.org/W2065283382","https://openalex.org/W2066142272","https://openalex.org/W2068034418","https://openalex.org/W2070061120","https://openalex.org/W2075793367","https://openalex.org/W2107020701","https://openalex.org/W2128705810","https://openalex.org/W2132717858","https://openalex.org/W2134428146","https://openalex.org/W2160053097","https://openalex.org/W2165011009","https://openalex.org/W2301131921"],"related_works":["https://openalex.org/W2414044935","https://openalex.org/W4386639869","https://openalex.org/W1482407871","https://openalex.org/W2150504905","https://openalex.org/W2103983684","https://openalex.org/W2044365359","https://openalex.org/W1977899148","https://openalex.org/W2032184590","https://openalex.org/W2411309046","https://openalex.org/W2186305834"],"abstract_inverted_index":null,"counts_by_year":[{"year":2018,"cited_by_count":1},{"year":2017,"cited_by_count":2},{"year":2016,"cited_by_count":1},{"year":2014,"cited_by_count":1},{"year":2012,"cited_by_count":2}],"updated_date":"2026-07-23T08:03:31.855105","created_date":"2025-10-10T00:00:00"}