{"id":"https://openalex.org/W3004554241","doi":"https://doi.org/10.1021/acs.jcim.9b01083","title":"Design, Synthesis, and Molecular Modeling Studies of Novel Coumarin Carboxamide Derivatives as eEF-2K Inhibitors","display_name":"Design, Synthesis, and Molecular Modeling Studies of Novel Coumarin Carboxamide Derivatives as eEF-2K Inhibitors","publication_year":2020,"publication_date":"2020-02-06","ids":{"openalex":"https://openalex.org/W3004554241","doi":"https://doi.org/10.1021/acs.jcim.9b01083","mag":"3004554241","pmid":"https://pubmed.ncbi.nlm.nih.gov/32027127"},"language":"en","primary_location":{"id":"doi:10.1021/acs.jcim.9b01083","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jcim.9b01083","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":"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/A5039693391","display_name":"Ferah C\u00f6mert \u00d6nder","orcid":"https://orcid.org/0000-0002-4037-1979"},"institutions":[{"id":"https://openalex.org/I115953327","display_name":"\u00c7anakkale Onsekiz Mart \u00dcniversitesi","ror":"https://ror.org/05rsv8p09","country_code":"TR","type":"education","lineage":["https://openalex.org/I115953327"]},{"id":"https://openalex.org/I1343551460","display_name":"The University of Texas MD Anderson Cancer Center","ror":"https://ror.org/04twxam07","country_code":"US","type":"healthcare","lineage":["https://openalex.org/I1343551460"]}],"countries":["TR","US"],"is_corresponding":false,"raw_author_name":"Ferah Comert Onder","raw_affiliation_strings":["Department of Chemistry, Faculty of Science and Arts, Natural Products and Drug Research Laboratory, Canakkale Onsekiz Mart University, 17020 Canakkale, Turkey","Department of Experimental Therapeutics, The University of Texas MD Anderson Cancer Center, 1515 Holcombe Boulevard, Unit 422, Houston, Texas 77030, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Faculty of Science and Arts, Natural Products and Drug Research Laboratory, Canakkale Onsekiz Mart University, 17020 Canakkale, Turkey","institution_ids":["https://openalex.org/I115953327"]},{"raw_affiliation_string":"Department of Experimental Therapeutics, The University of Texas MD Anderson Cancer Center, 1515 Holcombe Boulevard, Unit 422, Houston, Texas 77030, United States","institution_ids":["https://openalex.org/I1343551460"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5080235407","display_name":"Serdar Durda\u011f\u0131","orcid":"https://orcid.org/0000-0002-0426-0905"},"institutions":[{"id":"https://openalex.org/I128277893","display_name":"Bah\u00e7e\u015fehir University","ror":"https://ror.org/00yze4d93","country_code":"TR","type":"education","lineage":["https://openalex.org/I128277893"]}],"countries":["TR"],"is_corresponding":true,"raw_author_name":"Serdar Durdagi","raw_affiliation_strings":["Department of Biophysics, School of Medicine, Computational Biology and Molecular Simulations Laboratory, Bahcesehir University, Kadikoy, 34734 Istanbul, Turkey"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Biophysics, School of Medicine, Computational Biology and Molecular Simulations Laboratory, Bahcesehir University, Kadikoy, 34734 Istanbul, Turkey","institution_ids":["https://openalex.org/I128277893"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5010690232","display_name":"Kader \u015eahin","orcid":"https://orcid.org/0000-0002-9056-9000"},"institutions":[{"id":"https://openalex.org/I128277893","display_name":"Bah\u00e7e\u015fehir University","ror":"https://ror.org/00yze4d93","country_code":"TR","type":"education","lineage":["https://openalex.org/I128277893"]}],"countries":["TR"],"is_corresponding":false,"raw_author_name":"Kader Sahin","raw_affiliation_strings":["Department of Biophysics, School of Medicine, Computational Biology and Molecular Simulations Laboratory, Bahcesehir University, Kadikoy, 34734 Istanbul, Turkey"],"raw_orcid":"https://orcid.org/0000-0002-9056-9000","affiliations":[{"raw_affiliation_string":"Department of Biophysics, School of Medicine, Computational Biology and Molecular Simulations Laboratory, Bahcesehir University, Kadikoy, 34734 Istanbul, Turkey","institution_ids":["https://openalex.org/I128277893"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5040193650","display_name":"B\u00fclent \u00d6zpolat","orcid":null},"institutions":[{"id":"https://openalex.org/I1343551460","display_name":"The University of Texas MD Anderson Cancer Center","ror":"https://ror.org/04twxam07","country_code":"US","type":"healthcare","lineage":["https://openalex.org/I1343551460"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Bulent Ozpolat","raw_affiliation_strings":["Center for RNA Interference and Non-Coding RNAs, The University of Texas MD Anderson Cancer Center, Houston, Texas 77030, United States","Department of Experimental Therapeutics, The University of Texas MD Anderson Cancer Center, 1515 Holcombe Boulevard, Unit 422, Houston, Texas 77030, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Center for RNA Interference and Non-Coding RNAs, The University of Texas MD Anderson Cancer Center, Houston, Texas 77030, United States","institution_ids":["https://openalex.org/I1343551460"]},{"raw_affiliation_string":"Department of Experimental Therapeutics, The University of Texas MD Anderson Cancer Center, 1515 Holcombe Boulevard, Unit 422, Houston, Texas 77030, United States","institution_ids":["https://openalex.org/I1343551460"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5029816308","display_name":"Mehmet Ay","orcid":"https://orcid.org/0000-0002-1095-1614"},"institutions":[{"id":"https://openalex.org/I115953327","display_name":"\u00c7anakkale Onsekiz Mart \u00dcniversitesi","ror":"https://ror.org/05rsv8p09","country_code":"TR","type":"education","lineage":["https://openalex.org/I115953327"]}],"countries":["TR"],"is_corresponding":true,"raw_author_name":"Mehmet Ay","raw_affiliation_strings":["Department of Chemistry, Faculty of Science and Arts, Natural Products and Drug Research Laboratory, Canakkale Onsekiz Mart University, 17020 Canakkale, Turkey"],"raw_orcid":"https://orcid.org/0000-0002-1095-1614","affiliations":[{"raw_affiliation_string":"Department of Chemistry, Faculty of Science and Arts, Natural Products and Drug Research Laboratory, Canakkale Onsekiz Mart University, 17020 Canakkale, Turkey","institution_ids":["https://openalex.org/I115953327"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":5,"corresponding_author_ids":["https://openalex.org/A5029816308","https://openalex.org/A5040193650","https://openalex.org/A5080235407"],"corresponding_institution_ids":["https://openalex.org/I115953327","https://openalex.org/I128277893","https://openalex.org/I1343551460"],"apc_list":null,"apc_paid":null,"fwci":1.9251,"has_fulltext":false,"cited_by_count":27,"citation_normalized_percentile":{"value":0.84770174,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":94,"max":99},"biblio":{"volume":"60","issue":"3","first_page":"1766","last_page":"1778"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11440","display_name":"Click Chemistry and Applications","score":0.9983000159263611,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T11440","display_name":"Click Chemistry and Applications","score":0.9983000159263611,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10911","display_name":"Chemical Synthesis and Analysis","score":0.9976999759674072,"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/T11845","display_name":"Cancer therapeutics and mechanisms","score":0.9879000186920166,"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/in-silico","display_name":"In silico","score":0.8442573547363281},{"id":"https://openalex.org/keywords/in-vitro","display_name":"In vitro","score":0.582046389579773},{"id":"https://openalex.org/keywords/in-vivo","display_name":"In vivo","score":0.5622396469116211},{"id":"https://openalex.org/keywords/molecular-model","display_name":"Molecular model","score":0.5519348382949829},{"id":"https://openalex.org/keywords/homology-modeling","display_name":"Homology modeling","score":0.5186766386032104},{"id":"https://openalex.org/keywords/molecular-mechanics","display_name":"Molecular mechanics","score":0.48600324988365173},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.4230739176273346},{"id":"https://openalex.org/keywords/coumarin","display_name":"Coumarin","score":0.42283254861831665},{"id":"https://openalex.org/keywords/kinase","display_name":"Kinase","score":0.41823622584342957},{"id":"https://openalex.org/keywords/cancer-research","display_name":"Cancer research","score":0.382824182510376},{"id":"https://openalex.org/keywords/pharmacology","display_name":"Pharmacology","score":0.3677409291267395},{"id":"https://openalex.org/keywords/computational-biology","display_name":"Computational biology","score":0.33325695991516113},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.3290288746356964},{"id":"https://openalex.org/keywords/stereochemistry","display_name":"Stereochemistry","score":0.2547187805175781},{"id":"https://openalex.org/keywords/biochemistry","display_name":"Biochemistry","score":0.25301671028137207},{"id":"https://openalex.org/keywords/enzyme","display_name":"Enzyme","score":0.24371781945228577},{"id":"https://openalex.org/keywords/molecular-dynamics","display_name":"Molecular dynamics","score":0.14884960651397705},{"id":"https://openalex.org/keywords/genetics","display_name":"Genetics","score":0.08869734406471252},{"id":"https://openalex.org/keywords/gene","display_name":"Gene","score":0.08735406398773193}],"concepts":[{"id":"https://openalex.org/C2775905019","wikidata":"https://www.wikidata.org/wiki/Q192572","display_name":"In silico","level":3,"score":0.8442573547363281},{"id":"https://openalex.org/C202751555","wikidata":"https://www.wikidata.org/wiki/Q221681","display_name":"In vitro","level":2,"score":0.582046389579773},{"id":"https://openalex.org/C207001950","wikidata":"https://www.wikidata.org/wiki/Q141124","display_name":"In vivo","level":2,"score":0.5622396469116211},{"id":"https://openalex.org/C178910836","wikidata":"https://www.wikidata.org/wiki/Q2196961","display_name":"Molecular model","level":2,"score":0.5519348382949829},{"id":"https://openalex.org/C169627665","wikidata":"https://www.wikidata.org/wiki/Q5767913","display_name":"Homology modeling","level":3,"score":0.5186766386032104},{"id":"https://openalex.org/C25057246","wikidata":"https://www.wikidata.org/wiki/Q1344441","display_name":"Molecular mechanics","level":3,"score":0.48600324988365173},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.4230739176273346},{"id":"https://openalex.org/C2781338262","wikidata":"https://www.wikidata.org/wiki/Q111812","display_name":"Coumarin","level":2,"score":0.42283254861831665},{"id":"https://openalex.org/C184235292","wikidata":"https://www.wikidata.org/wiki/Q421851","display_name":"Kinase","level":2,"score":0.41823622584342957},{"id":"https://openalex.org/C502942594","wikidata":"https://www.wikidata.org/wiki/Q3421914","display_name":"Cancer research","level":1,"score":0.382824182510376},{"id":"https://openalex.org/C98274493","wikidata":"https://www.wikidata.org/wiki/Q128406","display_name":"Pharmacology","level":1,"score":0.3677409291267395},{"id":"https://openalex.org/C70721500","wikidata":"https://www.wikidata.org/wiki/Q177005","display_name":"Computational biology","level":1,"score":0.33325695991516113},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.3290288746356964},{"id":"https://openalex.org/C71240020","wikidata":"https://www.wikidata.org/wiki/Q186011","display_name":"Stereochemistry","level":1,"score":0.2547187805175781},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.25301671028137207},{"id":"https://openalex.org/C181199279","wikidata":"https://www.wikidata.org/wiki/Q8047","display_name":"Enzyme","level":2,"score":0.24371781945228577},{"id":"https://openalex.org/C59593255","wikidata":"https://www.wikidata.org/wiki/Q901663","display_name":"Molecular dynamics","level":2,"score":0.14884960651397705},{"id":"https://openalex.org/C54355233","wikidata":"https://www.wikidata.org/wiki/Q7162","display_name":"Genetics","level":1,"score":0.08869734406471252},{"id":"https://openalex.org/C104317684","wikidata":"https://www.wikidata.org/wiki/Q7187","display_name":"Gene","level":2,"score":0.08735406398773193},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.0},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.0}],"mesh":[{"descriptor_ui":"D003374","descriptor_name":"Coumarins","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D003374","descriptor_name":"Coumarins","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D003374","descriptor_name":"Coumarins","qualifier_ui":"Q000494","qualifier_name":"pharmacology","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":"D009369","descriptor_name":"Neoplasms","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D009369","descriptor_name":"Neoplasms","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D009369","descriptor_name":"Neoplasms","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D054736","descriptor_name":"Elongation Factor 2 Kinase","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D054736","descriptor_name":"Elongation Factor 2 Kinase","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D054736","descriptor_name":"Elongation Factor 2 Kinase","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true}],"locations_count":3,"locations":[{"id":"doi:10.1021/acs.jcim.9b01083","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jcim.9b01083","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:32027127","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/32027127","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:8f8585c5-6865-4c74-8457-3196e8c938d4","is_oa":false,"landing_page_url":"https://avesis.comu.edu.tr/publication/details/8f8585c5-6865-4c74-8457-3196e8c938d4/oai","pdf_url":null,"source":{"id":"https://openalex.org/S7407055198","display_name":"\u00c7anakkale Onsekiz Mart University AVESIS","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"info:eu-repo/semantics/article"}],"best_oa_location":null,"sustainable_development_goals":[{"id":"https://metadata.un.org/sdg/3","display_name":"Good health and well-being","score":0.800000011920929}],"awards":[{"id":"https://openalex.org/G1991958910","display_name":null,"funder_award_id":"BIDEB 2214A","funder_id":"https://openalex.org/F4320322626","funder_display_name":"T\u00fcrkiye Bilimsel ve Teknolojik Ara\u015ft\u0131rma Kurumu"},{"id":"https://openalex.org/G651485577","display_name":null,"funder_award_id":"SBAG-215S008","funder_id":"https://openalex.org/F4320322626","funder_display_name":"T\u00fcrkiye Bilimsel ve Teknolojik Ara\u015ft\u0131rma Kurumu"}],"funders":[{"id":"https://openalex.org/F4320322626","display_name":"T\u00fcrkiye Bilimsel ve Teknolojik Ara\u015ft\u0131rma Kurumu","ror":"https://ror.org/04w9kkr77"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":69,"referenced_works":["https://openalex.org/W1605006988","https://openalex.org/W1608912889","https://openalex.org/W1895971900","https://openalex.org/W1961992856","https://openalex.org/W1964614825","https://openalex.org/W1968979864","https://openalex.org/W1972823610","https://openalex.org/W1974880836","https://openalex.org/W1975691556","https://openalex.org/W1981958990","https://openalex.org/W1985917494","https://openalex.org/W1990906694","https://openalex.org/W1991794210","https://openalex.org/W1992534600","https://openalex.org/W1992816203","https://openalex.org/W1996840082","https://openalex.org/W2000602679","https://openalex.org/W2012604457","https://openalex.org/W2019960359","https://openalex.org/W2020681885","https://openalex.org/W2026235754","https://openalex.org/W2027423337","https://openalex.org/W2028793394","https://openalex.org/W2031168104","https://openalex.org/W2032220293","https://openalex.org/W2041189078","https://openalex.org/W2043033793","https://openalex.org/W2043509228","https://openalex.org/W2051124828","https://openalex.org/W2053983236","https://openalex.org/W2058105012","https://openalex.org/W2060129021","https://openalex.org/W2070697777","https://openalex.org/W2074197341","https://openalex.org/W2075951376","https://openalex.org/W2080670217","https://openalex.org/W2085282075","https://openalex.org/W2092346007","https://openalex.org/W2093881154","https://openalex.org/W2100806057","https://openalex.org/W2119158234","https://openalex.org/W2133420284","https://openalex.org/W2138685395","https://openalex.org/W2140247386","https://openalex.org/W2144908288","https://openalex.org/W2288539668","https://openalex.org/W2332896222","https://openalex.org/W2345866556","https://openalex.org/W2407272549","https://openalex.org/W2410758979","https://openalex.org/W2478249342","https://openalex.org/W2567652734","https://openalex.org/W2573621555","https://openalex.org/W2592690910","https://openalex.org/W2602318789","https://openalex.org/W2742081931","https://openalex.org/W2770145603","https://openalex.org/W2772937698","https://openalex.org/W2792319416","https://openalex.org/W2796326051","https://openalex.org/W2800466848","https://openalex.org/W2801012801","https://openalex.org/W2811008574","https://openalex.org/W2884665780","https://openalex.org/W2895264766","https://openalex.org/W2913795159","https://openalex.org/W3140543543","https://openalex.org/W4247904703","https://openalex.org/W4251523766"],"related_works":["https://openalex.org/W2018797442","https://openalex.org/W2141873118","https://openalex.org/W2409560350","https://openalex.org/W1970447014","https://openalex.org/W1500542410","https://openalex.org/W2087876094","https://openalex.org/W2415830448","https://openalex.org/W2373356664","https://openalex.org/W2128732604","https://openalex.org/W2944893694"],"abstract_inverted_index":{"may":[0],"be":[1],"used":[2],"as":[3],"novel":[4],"eEF-2K":[5],"inhibitors":[6],"with":[7],"potential":[8],"therapeutic":[9],"applications.":[10]},"counts_by_year":[{"year":2026,"cited_by_count":1},{"year":2025,"cited_by_count":6},{"year":2024,"cited_by_count":2},{"year":2023,"cited_by_count":3},{"year":2022,"cited_by_count":4},{"year":2021,"cited_by_count":8},{"year":2020,"cited_by_count":3}],"updated_date":"2026-04-28T14:05:53.105641","created_date":"2025-10-10T00:00:00"}
