{"id":"https://openalex.org/W2768579739","doi":"https://doi.org/10.1021/acs.jcim.7b00536","title":"Successful Identification of Cardiac Troponin Calcium Sensitizers Using a Combination of Virtual Screening and ROC Analysis of Known Troponin C Binders","display_name":"Successful Identification of Cardiac Troponin Calcium Sensitizers Using a Combination of Virtual Screening and ROC Analysis of Known Troponin C Binders","publication_year":2017,"publication_date":"2017-11-16","ids":{"openalex":"https://openalex.org/W2768579739","doi":"https://doi.org/10.1021/acs.jcim.7b00536","mag":"2768579739","pmid":"https://pubmed.ncbi.nlm.nih.gov/29144742"},"language":"en","primary_location":{"id":"doi:10.1021/acs.jcim.7b00536","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jcim.7b00536","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/A5022701977","display_name":"Melanie L. Aprahamian","orcid":null},"institutions":[{"id":"https://openalex.org/I52357470","display_name":"The Ohio State University","ror":"https://ror.org/00rs6vg23","country_code":"US","type":"education","lineage":["https://openalex.org/I52357470"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Melanie L. Aprahamian","raw_affiliation_strings":["Department of Chemistry and Biochemistry, Ohio State University, Columbus, Ohio 43210, United States","Department\rof Chemistry and Biochemistry, Ohio State University, Columbus, Ohio 43210, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry and Biochemistry, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":["https://openalex.org/I52357470"]},{"raw_affiliation_string":"Department\rof Chemistry and Biochemistry, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":["https://openalex.org/I52357470"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5005403838","display_name":"Svetlana B. Tikunova","orcid":"https://orcid.org/0000-0002-2101-9996"},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Svetlana B. Tikunova","raw_affiliation_strings":["Davis Heart and Lung Research Institute and Department of Physiology and Cell Biology, Ohio State University, Columbus, Ohio 43210, United States","Davis\rHeart and Lung Research Institute and Department of Physiology and\rCell Biology, Ohio State University, Columbus, Ohio 43210, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Davis Heart and Lung Research Institute and Department of Physiology and Cell Biology, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":[]},{"raw_affiliation_string":"Davis\rHeart and Lung Research Institute and Department of Physiology and\rCell Biology, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5004603375","display_name":"Morgan V. Price","orcid":null},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Morgan V. Price","raw_affiliation_strings":["Davis Heart and Lung Research Institute and Department of Physiology and Cell Biology, Ohio State University, Columbus, Ohio 43210, United States","Davis\rHeart and Lung Research Institute and Department of Physiology and\rCell Biology, Ohio State University, Columbus, Ohio 43210, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Davis Heart and Lung Research Institute and Department of Physiology and Cell Biology, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":[]},{"raw_affiliation_string":"Davis\rHeart and Lung Research Institute and Department of Physiology and\rCell Biology, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5047646014","display_name":"Andres F. Cuesta","orcid":null},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Andres F. Cuesta","raw_affiliation_strings":["Davis Heart and Lung Research Institute and Department of Physiology and Cell Biology, Ohio State University, Columbus, Ohio 43210, United States","Davis\rHeart and Lung Research Institute and Department of Physiology and\rCell Biology, Ohio State University, Columbus, Ohio 43210, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Davis Heart and Lung Research Institute and Department of Physiology and Cell Biology, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":[]},{"raw_affiliation_string":"Davis\rHeart and Lung Research Institute and Department of Physiology and\rCell Biology, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5110680199","display_name":"Jonathan P. Davis","orcid":"https://orcid.org/0000-0002-5627-1550"},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Jonathan P. Davis","raw_affiliation_strings":["Davis Heart and Lung Research Institute and Department of Physiology and Cell Biology, Ohio State University, Columbus, Ohio 43210, United States","Davis\rHeart and Lung Research Institute and Department of Physiology and\rCell Biology, Ohio State University, Columbus, Ohio 43210, United States"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Davis Heart and Lung Research Institute and Department of Physiology and Cell Biology, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":[]},{"raw_affiliation_string":"Davis\rHeart and Lung Research Institute and Department of Physiology and\rCell Biology, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":[]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5044975181","display_name":"Steffen Lindert","orcid":"https://orcid.org/0000-0002-3976-3473"},"institutions":[{"id":"https://openalex.org/I52357470","display_name":"The Ohio State University","ror":"https://ror.org/00rs6vg23","country_code":"US","type":"education","lineage":["https://openalex.org/I52357470"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Steffen Lindert","raw_affiliation_strings":["Department of Chemistry and Biochemistry, Ohio State University, Columbus, Ohio 43210, United States","Department\rof Chemistry and Biochemistry, Ohio State University, Columbus, Ohio 43210, United States"],"raw_orcid":"https://orcid.org/0000-0002-3976-3473","affiliations":[{"raw_affiliation_string":"Department of Chemistry and Biochemistry, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":["https://openalex.org/I52357470"]},{"raw_affiliation_string":"Department\rof Chemistry and Biochemistry, Ohio State University, Columbus, Ohio 43210, United States","institution_ids":["https://openalex.org/I52357470"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":6,"corresponding_author_ids":["https://openalex.org/A5044975181"],"corresponding_institution_ids":["https://openalex.org/I52357470"],"apc_list":null,"apc_paid":null,"fwci":1.1217,"has_fulltext":false,"cited_by_count":18,"citation_normalized_percentile":{"value":0.77919481,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":90,"max":98},"biblio":{"volume":"57","issue":"12","first_page":"3056","last_page":"3069"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T12620","display_name":"Signaling Pathways in Disease","score":0.9821000099182129,"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"}},"topics":[{"id":"https://openalex.org/T12620","display_name":"Signaling Pathways in Disease","score":0.9821000099182129,"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/T10211","display_name":"Computational Drug Discovery Methods","score":0.9797999858856201,"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/T10521","display_name":"RNA and protein synthesis mechanisms","score":0.9228000044822693,"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/troponin","display_name":"Troponin","score":0.6649294495582581},{"id":"https://openalex.org/keywords/cardiology","display_name":"Cardiology","score":0.5956090092658997},{"id":"https://openalex.org/keywords/identification","display_name":"Identification (biology)","score":0.5608218908309937},{"id":"https://openalex.org/keywords/virtual-screening","display_name":"Virtual screening","score":0.5416766405105591},{"id":"https://openalex.org/keywords/troponin-i","display_name":"Troponin I","score":0.5220301151275635},{"id":"https://openalex.org/keywords/internal-medicine","display_name":"Internal medicine","score":0.5136948823928833},{"id":"https://openalex.org/keywords/medicine","display_name":"Medicine","score":0.4700568914413452},{"id":"https://openalex.org/keywords/troponin-c","display_name":"Troponin C","score":0.4610002040863037},{"id":"https://openalex.org/keywords/calcium","display_name":"Calcium","score":0.45721742510795593},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.3014281094074249},{"id":"https://openalex.org/keywords/biochemistry","display_name":"Biochemistry","score":0.14122554659843445},{"id":"https://openalex.org/keywords/myocardial-infarction","display_name":"Myocardial infarction","score":0.13311415910720825},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.07048863172531128},{"id":"https://openalex.org/keywords/drug-discovery","display_name":"Drug discovery","score":0.06031501293182373}],"concepts":[{"id":"https://openalex.org/C36036425","wikidata":"https://www.wikidata.org/wiki/Q7846262","display_name":"Troponin","level":3,"score":0.6649294495582581},{"id":"https://openalex.org/C164705383","wikidata":"https://www.wikidata.org/wiki/Q10379","display_name":"Cardiology","level":1,"score":0.5956090092658997},{"id":"https://openalex.org/C116834253","wikidata":"https://www.wikidata.org/wiki/Q2039217","display_name":"Identification (biology)","level":2,"score":0.5608218908309937},{"id":"https://openalex.org/C103697762","wikidata":"https://www.wikidata.org/wiki/Q4112105","display_name":"Virtual screening","level":3,"score":0.5416766405105591},{"id":"https://openalex.org/C115725540","wikidata":"https://www.wikidata.org/wiki/Q7846263","display_name":"Troponin I","level":3,"score":0.5220301151275635},{"id":"https://openalex.org/C126322002","wikidata":"https://www.wikidata.org/wiki/Q11180","display_name":"Internal medicine","level":1,"score":0.5136948823928833},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.4700568914413452},{"id":"https://openalex.org/C133927893","wikidata":"https://www.wikidata.org/wiki/Q4383200","display_name":"Troponin C","level":4,"score":0.4610002040863037},{"id":"https://openalex.org/C519063684","wikidata":"https://www.wikidata.org/wiki/Q706","display_name":"Calcium","level":2,"score":0.45721742510795593},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.3014281094074249},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.14122554659843445},{"id":"https://openalex.org/C500558357","wikidata":"https://www.wikidata.org/wiki/Q12152","display_name":"Myocardial infarction","level":2,"score":0.13311415910720825},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.07048863172531128},{"id":"https://openalex.org/C74187038","wikidata":"https://www.wikidata.org/wiki/Q1418791","display_name":"Drug discovery","level":2,"score":0.06031501293182373},{"id":"https://openalex.org/C59822182","wikidata":"https://www.wikidata.org/wiki/Q441","display_name":"Botany","level":1,"score":0.0}],"mesh":[{"descriptor_ui":"D000072417","descriptor_name":"Protein Domains","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000072417","descriptor_name":"Protein Domains","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000072417","descriptor_name":"Protein Domains","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D002118","descriptor_name":"Calcium","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D002118","descriptor_name":"Calcium","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D002118","descriptor_name":"Calcium","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D002839","descriptor_name":"Chromans","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D002839","descriptor_name":"Chromans","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D002839","descriptor_name":"Chromans","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D002839","descriptor_name":"Chromans","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D002839","descriptor_name":"Chromans","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D002839","descriptor_name":"Chromans","qualifier_ui":"Q000737","qualifier_name":"chemistry","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":"D011485","descriptor_name":"Protein Binding","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011485","descriptor_name":"Protein Binding","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011485","descriptor_name":"Protein Binding","qualifier_ui":null,"qualifier_name":null,"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":"D017076","descriptor_name":"Computer-Aided Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D017076","descriptor_name":"Computer-Aided Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D017076","descriptor_name":"Computer-Aided Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D019209","descriptor_name":"Troponin C","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019209","descriptor_name":"Troponin C","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019209","descriptor_name":"Troponin C","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019209","descriptor_name":"Troponin C","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D019209","descriptor_name":"Troponin C","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D019209","descriptor_name":"Troponin C","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D019210","descriptor_name":"Troponin I","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019210","descriptor_name":"Troponin I","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019210","descriptor_name":"Troponin I","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019210","descriptor_name":"Troponin I","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D019210","descriptor_name":"Troponin I","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D019210","descriptor_name":"Troponin I","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D062105","descriptor_name":"Molecular Docking Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D062105","descriptor_name":"Molecular Docking Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D062105","descriptor_name":"Molecular Docking Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false}],"locations_count":3,"locations":[{"id":"doi:10.1021/acs.jcim.7b00536","is_oa":false,"landing_page_url":"https://doi.org/10.1021/acs.jcim.7b00536","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:29144742","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/29144742","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:europepmc.org:5274030","is_oa":false,"landing_page_url":"https://www.ncbi.nlm.nih.gov/pmc/articles/5743627","pdf_url":null,"source":{"id":"https://openalex.org/S4306400806","display_name":"Europe PMC (PubMed Central)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I1303153112","host_organization_name":"European Bioinformatics Institute","host_organization_lineage":["https://openalex.org/I1303153112"],"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":"Text"}],"best_oa_location":null,"sustainable_development_goals":[{"id":"https://metadata.un.org/sdg/3","score":0.7799999713897705,"display_name":"Good health and well-being"}],"awards":[{"id":"https://openalex.org/G1222871543","display_name":null,"funder_award_id":"R01 HL138579","funder_id":"https://openalex.org/F4320337338","funder_display_name":"National Heart, Lung, and Blood Institute"},{"id":"https://openalex.org/G2359810619","display_name":null,"funder_award_id":"R03 AG054904","funder_id":"https://openalex.org/F4320337337","funder_display_name":"National Institute on Aging"},{"id":"https://openalex.org/G7489137939","display_name":null,"funder_award_id":"R01 HL132213","funder_id":"https://openalex.org/F4320337338","funder_display_name":"National Heart, Lung, and Blood Institute"}],"funders":[{"id":"https://openalex.org/F4320337337","display_name":"National Institute on Aging","ror":"https://ror.org/049v75w11"},{"id":"https://openalex.org/F4320337338","display_name":"National Heart, Lung, and Blood Institute","ror":"https://ror.org/012pb6c26"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":86,"referenced_works":["https://openalex.org/W947071345","https://openalex.org/W1062333943","https://openalex.org/W1530310488","https://openalex.org/W1556535974","https://openalex.org/W1748374584","https://openalex.org/W1834130069","https://openalex.org/W1874341760","https://openalex.org/W1901823973","https://openalex.org/W1941606642","https://openalex.org/W1970159829","https://openalex.org/W1970400205","https://openalex.org/W1976586841","https://openalex.org/W1980240737","https://openalex.org/W1985588649","https://openalex.org/W1990049123","https://openalex.org/W1990724722","https://openalex.org/W1992597530","https://openalex.org/W1996547062","https://openalex.org/W1999108200","https://openalex.org/W1999847605","https://openalex.org/W2000876750","https://openalex.org/W2003127541","https://openalex.org/W2004203772","https://openalex.org/W2004310028","https://openalex.org/W2009423060","https://openalex.org/W2014276094","https://openalex.org/W2015041732","https://openalex.org/W2017397568","https://openalex.org/W2019732485","https://openalex.org/W2020288705","https://openalex.org/W2021832765","https://openalex.org/W2022849573","https://openalex.org/W2027423337","https://openalex.org/W2028517473","https://openalex.org/W2031168104","https://openalex.org/W2032463428","https://openalex.org/W2040767088","https://openalex.org/W2040954790","https://openalex.org/W2041189078","https://openalex.org/W2043509228","https://openalex.org/W2043956489","https://openalex.org/W2045600823","https://openalex.org/W2045722951","https://openalex.org/W2047509756","https://openalex.org/W2051381895","https://openalex.org/W2056263057","https://openalex.org/W2056881083","https://openalex.org/W2058659664","https://openalex.org/W2067014806","https://openalex.org/W2073466565","https://openalex.org/W2075221169","https://openalex.org/W2078405212","https://openalex.org/W2080113872","https://openalex.org/W2080369559","https://openalex.org/W2083616386","https://openalex.org/W2085351556","https://openalex.org/W2086679514","https://openalex.org/W2090750603","https://openalex.org/W2095103531","https://openalex.org/W2096007970","https://openalex.org/W2096608221","https://openalex.org/W2102377211","https://openalex.org/W2105382995","https://openalex.org/W2121273087","https://openalex.org/W2124811694","https://openalex.org/W2129438079","https://openalex.org/W2133641393","https://openalex.org/W2134033040","https://openalex.org/W2136010626","https://openalex.org/W2143722956","https://openalex.org/W2145041436","https://openalex.org/W2147895266","https://openalex.org/W2151792773","https://openalex.org/W2154462363","https://openalex.org/W2161134038","https://openalex.org/W2161427213","https://openalex.org/W2222589778","https://openalex.org/W2281888467","https://openalex.org/W2293809154","https://openalex.org/W2294751189","https://openalex.org/W2304131176","https://openalex.org/W2332896222","https://openalex.org/W2567231876","https://openalex.org/W2578590075","https://openalex.org/W2592122267","https://openalex.org/W4205395603"],"related_works":["https://openalex.org/W1999689773","https://openalex.org/W2049996685","https://openalex.org/W2346785564","https://openalex.org/W33325980","https://openalex.org/W1892398115","https://openalex.org/W1748839846","https://openalex.org/W2420862808","https://openalex.org/W1900711230","https://openalex.org/W2462444579","https://openalex.org/W1895579579"],"abstract_inverted_index":{"Calcium-dependent":[0],"cardiac":[1,227],"muscle":[2,228],"contraction":[3],"is":[4,29,234],"regulated":[5],"by":[6,81],"the":[7,14,23,39,54,67,72,103,114,142,183,186,198,207,224],"protein":[8],"complex":[9,108],"troponin.":[10],"Calcium":[11],"binds":[12],"to":[13,48,52,66,125,237],"N-terminal":[15],"domain":[16,188],"of":[17,25,32,35,41,57,105,141,153,180,185,189,193,206,226,235,242],"troponin":[18],"C":[19],"(cNTnC)":[20],"which":[21],"initiates":[22],"process":[24],"contraction.":[26,229],"Heart":[27],"failure":[28],"a":[30,33,44,96,106,132,138,150,215,219],"consequence":[31],"disruption":[34],"this":[36,42,232],"process.":[37],"With":[38],"prevalence":[40],"condition,":[43],"strong":[45],"need":[46],"exists":[47],"find":[49],"novel":[50,91,168],"compounds":[51],"increase":[53],"calcium":[55,78,178,199,209,245],"sensitivity":[56,179],"cNTnC.":[58],"Desirable":[59],"are":[60],"small":[61,151],"chemical":[62],"molecules":[63,154],"that":[64,101,175,205],"bind":[65],"interface":[68],"between":[69],"cTnC":[70,84,181],"and":[71,76,161,172,195],"cTnI":[73],"switch":[74],"peptide":[75],"exhibit":[77],"sensitizing":[79],"properties":[80],"possibly":[82],"stabilizing":[83],"in":[85,182,223],"an":[86],"open":[87],"conformation.":[88],"To":[89],"identify":[90],"drug":[92,98],"candidates,":[93],"we":[94,213],"employed":[95],"structure-based":[97],"discovery":[99],"protocol":[100],"incorporated":[102],"use":[104],"relaxed":[107],"scheme":[109],"(RCS).":[110],"In":[111],"preparation":[112],"for":[113,244],"virtual":[115,139],"screening,":[116],"cNTnC":[117,129],"conformations":[118],"were":[119,155],"identified":[120,166,214],"based":[121],"on":[122,197,231,240],"their":[123],"ability":[124],"correctly":[126],"predict":[127],"known":[128,208],"binders":[130],"using":[131,158],"receiver":[133],"operating":[134],"characteristics":[135],"analysis.":[136],"Following":[137],"screen":[140],"National":[143],"Cancer":[144],"Institute's":[145],"Developmental":[146],"Therapeutic":[147],"Program":[148],"database,":[149],"number":[152],"experimentally":[156],"tested":[157],"stopped-flow":[159],"kinetics":[160],"steady-state":[162],"fluorescence":[163],"titrations.":[164],"We":[165],"two":[167],"compounds,":[169],"3-(4-methoxyphenyl)-6,7-chromanediol":[170],"(NSC600285)":[171],"3-(4-methylphenyl)-7,8-chromanediol":[173],"(NSC611817),":[174],"show":[176],"increased":[177],"presence":[184],"regulatory":[187],"cTnI.":[190],"The":[191],"effects":[192],"NSC600285":[194],"NSC611817":[196],"dissociation":[200],"rate":[201],"was":[202],"stronger":[203],"than":[204],"sensitizer":[210],"bepridil.":[211],"Thus,":[212],"3-phenylchromane":[216],"group":[217],"as":[218],"possible":[220],"key":[221],"pharmacophore":[222],"sensitization":[225],"Building":[230],"finding":[233],"interest":[236],"researchers":[238],"working":[239],"development":[241],"drugs":[243],"sensitization.":[246]},"counts_by_year":[{"year":2024,"cited_by_count":1},{"year":2023,"cited_by_count":3},{"year":2022,"cited_by_count":5},{"year":2020,"cited_by_count":3},{"year":2019,"cited_by_count":4},{"year":2018,"cited_by_count":2}],"updated_date":"2026-06-16T07:32:37.131356","created_date":"2025-10-10T00:00:00"}