{"id":"https://openalex.org/W1976802454","doi":"https://doi.org/10.3390/molecules191016543","title":"Playing with Opening and Closing of Heterocycles: Using the Cusmano-Ruccia Reaction to Develop a Novel Class of Oxadiazolothiazinones, Active as Calcium Channel Modulators and P-Glycoprotein Inhibitors","display_name":"Playing with Opening and Closing of Heterocycles: Using the Cusmano-Ruccia Reaction to Develop a Novel Class of Oxadiazolothiazinones, Active as Calcium Channel Modulators and P-Glycoprotein Inhibitors","publication_year":2014,"publication_date":"2014-10-14","ids":{"openalex":"https://openalex.org/W1976802454","doi":"https://doi.org/10.3390/molecules191016543","mag":"1976802454","pmid":"https://pubmed.ncbi.nlm.nih.gov/25317581","pmcid":"https://www.ncbi.nlm.nih.gov/pmc/articles/6271282"},"language":"en","primary_location":{"id":"doi:10.3390/molecules191016543","doi":"https://doi.org/10.3390/molecules191016543","is_oa":true,"landing_page_url":"http://dx.doi.org/10.3390/molecules191016543","pdf_url":"https://www.mdpi.com/1420-3049/19/10/16543/pdf?version=1413286811","source":{"id":"https://openalex.org/S108911230","display_name":"Molecules","issn_l":"1420-3049","issn":["1420-3049","1433-1373"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["anvur-scientific","cwts-core","doaj","medline","poland-140","russia-white-list-1"],"host_organization":"https://openalex.org/P4310310987","host_organization_name":"Multidisciplinary Digital Publishing Institute","host_organization_lineage":["https://openalex.org/P4310310987"],"host_organization_lineage_names":["Multidisciplinary Digital Publishing Institute"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Molecules","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref","doaj","pubmed"],"open_access":{"is_oa":true,"oa_status":"gold","oa_url":"https://www.mdpi.com/1420-3049/19/10/16543/pdf?version=1413286811","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5101817248","display_name":"Domenico Spinelli","orcid":"https://orcid.org/0000-0002-5847-0748","observed_orcids":["https://orcid.org/0000-0002-5847-0748"]},"institutions":[{"id":"https://openalex.org/I9360294","display_name":"University of Bologna","ror":"https://ror.org/01111rn36","country_code":"IT","type":"education","lineage":["https://openalex.org/I9360294"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Domenico Spinelli","raw_affiliation_strings":["Dipartimento di Chimica \"G. Ciamician\", Alma Mater Studiorum-Universit\u00e0 di Bologna, Via F. Selmi 2, Bologna 40126, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Chimica \"G. Ciamician\", Alma Mater Studiorum-Universit\u00e0 di Bologna, Via F. Selmi 2, Bologna 40126, Italy","institution_ids":["https://openalex.org/I9360294"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5084691569","display_name":"Roberta Budriesi","orcid":"https://orcid.org/0000-0002-8454-9740","observed_orcids":["https://orcid.org/0000-0002-8454-9740"]},"institutions":[{"id":"https://openalex.org/I9360294","display_name":"University of Bologna","ror":"https://ror.org/01111rn36","country_code":"IT","type":"education","lineage":["https://openalex.org/I9360294"]}],"countries":["IT"],"is_corresponding":true,"raw_author_name":"Roberta Budriesi","raw_affiliation_strings":["Dipartimento di Farmacia e Biotecnologie, Alma Mater Studiorum-Universit\u00e0 di Bologna, Via Belmeloro 6, Bologna 40126, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Farmacia e Biotecnologie, Alma Mater Studiorum-Universit\u00e0 di Bologna, Via Belmeloro 6, Bologna 40126, Italy","institution_ids":["https://openalex.org/I9360294"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5073017175","display_name":"Barbara Cosimelli","orcid":"https://orcid.org/0000-0002-3841-5389","observed_orcids":["https://orcid.org/0000-0002-3841-5389"]},"institutions":[{"id":"https://openalex.org/I71267560","display_name":"University of Naples Federico II","ror":"https://ror.org/05290cv24","country_code":"IT","type":"education","lineage":["https://openalex.org/I71267560"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Barbara Cosimelli","raw_affiliation_strings":["Dipartimento di Farmacia, Universit\u00e0 di Napoli \"Federico II\", Via D. Montesano 49, Napoli 80131, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Farmacia, Universit\u00e0 di Napoli \"Federico II\", Via D. Montesano 49, Napoli 80131, Italy","institution_ids":["https://openalex.org/I71267560"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5112070446","display_name":"Elda Severi","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I71267560","display_name":"University of Naples Federico II","ror":"https://ror.org/05290cv24","country_code":"IT","type":"education","lineage":["https://openalex.org/I71267560"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Elda Severi","raw_affiliation_strings":["Dipartimento di Farmacia, Universit\u00e0 di Napoli \"Federico II\", Via D. Montesano 49, Napoli 80131, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Farmacia, Universit\u00e0 di Napoli \"Federico II\", Via D. Montesano 49, Napoli 80131, Italy","institution_ids":["https://openalex.org/I71267560"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5014031258","display_name":"Matteo Micucci","orcid":"https://orcid.org/0000-0003-3525-1531","observed_orcids":["https://orcid.org/0000-0003-3525-1531"]},"institutions":[{"id":"https://openalex.org/I9360294","display_name":"University of Bologna","ror":"https://ror.org/01111rn36","country_code":"IT","type":"education","lineage":["https://openalex.org/I9360294"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Matteo Micucci","raw_affiliation_strings":["Dipartimento di Farmacia e Biotecnologie, Alma Mater Studiorum-Universit\u00e0 di Bologna, Via Belmeloro 6, Bologna 40126, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Farmacia e Biotecnologie, Alma Mater Studiorum-Universit\u00e0 di Bologna, Via Belmeloro 6, Bologna 40126, Italy","institution_ids":["https://openalex.org/I9360294"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5083725137","display_name":"Massimo Baroni","orcid":"https://orcid.org/0000-0003-0866-148X","observed_orcids":["https://orcid.org/0000-0003-0866-148X"]},"institutions":[{"id":"https://openalex.org/I4210165610","display_name":"Molecular Discovery (United Kingdom)","ror":"https://ror.org/0576dtf44","country_code":"GB","type":"company","lineage":["https://openalex.org/I4210165610"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Massimo Baroni","raw_affiliation_strings":["Molecular Discovery Ltd., 215 Marsh Road, Pinner, Middlesex HA5 5NE, UK"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Molecular Discovery Ltd., 215 Marsh Road, Pinner, Middlesex HA5 5NE, UK","institution_ids":["https://openalex.org/I4210165610"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5080577630","display_name":"Fabio Fusi","orcid":"https://orcid.org/0000-0002-5737-8309","observed_orcids":["https://orcid.org/0000-0002-5737-8309"]},"institutions":[{"id":"https://openalex.org/I102064193","display_name":"University of Siena","ror":"https://ror.org/01tevnk56","country_code":"IT","type":"education","lineage":["https://openalex.org/I102064193"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Fabio Fusi","raw_affiliation_strings":["Dipartimento di Scienze della Vita, Universit\u00e0 degli Studi di Siena, Via A. Moro 2, Siena 53100, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Scienze della Vita, Universit\u00e0 degli Studi di Siena, Via A. Moro 2, Siena 53100, Italy","institution_ids":["https://openalex.org/I102064193"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5072759825","display_name":"Pierfranco Ioan","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I9360294","display_name":"University of Bologna","ror":"https://ror.org/01111rn36","country_code":"IT","type":"education","lineage":["https://openalex.org/I9360294"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Pierfranco Ioan","raw_affiliation_strings":["Dipartimento di Farmacia e Biotecnologie, Alma Mater Studiorum-Universit\u00e0 di Bologna, Via Belmeloro 6, Bologna 40126, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Farmacia e Biotecnologie, Alma Mater Studiorum-Universit\u00e0 di Bologna, Via Belmeloro 6, Bologna 40126, Italy","institution_ids":["https://openalex.org/I9360294"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5032652911","display_name":"Simon Cross","orcid":"https://orcid.org/0000-0002-8736-4397","observed_orcids":["https://orcid.org/0000-0002-8736-4397"]},"institutions":[{"id":"https://openalex.org/I4210165610","display_name":"Molecular Discovery (United Kingdom)","ror":"https://ror.org/0576dtf44","country_code":"GB","type":"company","lineage":["https://openalex.org/I4210165610"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Simon Cross","raw_affiliation_strings":["Molecular Discovery Ltd., 215 Marsh Road, Pinner, Middlesex HA5 5NE, UK"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Molecular Discovery Ltd., 215 Marsh Road, Pinner, Middlesex HA5 5NE, UK","institution_ids":["https://openalex.org/I4210165610"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5015209672","display_name":"Maria Frosini","orcid":"https://orcid.org/0000-0002-4452-8128","observed_orcids":["https://orcid.org/0000-0002-4452-8128"]},"institutions":[{"id":"https://openalex.org/I102064193","display_name":"University of Siena","ror":"https://ror.org/01tevnk56","country_code":"IT","type":"education","lineage":["https://openalex.org/I102064193"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Maria Frosini","raw_affiliation_strings":["Dipartimento di Scienze della Vita, Universit\u00e0 degli Studi di Siena, Via A. Moro 2, Siena 53100, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Scienze della Vita, Universit\u00e0 degli Studi di Siena, Via A. Moro 2, Siena 53100, Italy","institution_ids":["https://openalex.org/I102064193"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5074743737","display_name":"Simona Saponara","orcid":"https://orcid.org/0000-0002-3831-8669","observed_orcids":["https://orcid.org/0000-0002-3831-8669"]},"institutions":[{"id":"https://openalex.org/I102064193","display_name":"University of Siena","ror":"https://ror.org/01tevnk56","country_code":"IT","type":"education","lineage":["https://openalex.org/I102064193"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Simona Saponara","raw_affiliation_strings":["Dipartimento di Scienze della Vita, Universit\u00e0 degli Studi di Siena, Via A. Moro 2, Siena 53100, Italy"],"raw_orcid":"https://orcid.org/0000-0002-3831-8669","affiliations":[{"raw_affiliation_string":"Dipartimento di Scienze della Vita, Universit\u00e0 degli Studi di Siena, Via A. Moro 2, Siena 53100, Italy","institution_ids":["https://openalex.org/I102064193"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5085206947","display_name":"Rosanna Matucci","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I45084792","display_name":"University of Florence","ror":"https://ror.org/04jr1s763","country_code":"IT","type":"education","lineage":["https://openalex.org/I45084792"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Rosanna Matucci","raw_affiliation_strings":["Dipartimento di Neuroscienze, Area del Farmaco e Salute del Bambino (NEUROFARBA) Viale Pieraccini 6, Firenze 50139, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Neuroscienze, Area del Farmaco e Salute del Bambino (NEUROFARBA) Viale Pieraccini 6, Firenze 50139, Italy","institution_ids":["https://openalex.org/I45084792"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5017004109","display_name":"Camillo Rosano","orcid":"https://orcid.org/0000-0003-2949-9215","observed_orcids":["https://orcid.org/0000-0003-2949-9215"]},"institutions":[{"id":"https://openalex.org/I4210146472","display_name":"Ospedale Policlinico San Martino","ror":"https://ror.org/04d7es448","country_code":"IT","type":"healthcare","lineage":["https://openalex.org/I4210146472","https://openalex.org/I4210153126","https://openalex.org/I4405264730"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Camillo Rosano","raw_affiliation_strings":["IRCCS Azienda Ospedaliera Universitaria San Martino\u2014IST Istituto Nazionale per la Ricerca sul Cancro, U.O.S. Biopolimeri e Proteomica, L.go R. Benzi, 10, Genova 16132, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"IRCCS Azienda Ospedaliera Universitaria San Martino\u2014IST Istituto Nazionale per la Ricerca sul Cancro, U.O.S. Biopolimeri e Proteomica, L.go R. Benzi, 10, Genova 16132, Italy","institution_ids":["https://openalex.org/I4210146472"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5006805442","display_name":"Maurizio Viale","orcid":"https://orcid.org/0000-0002-0673-5951","observed_orcids":["https://orcid.org/0000-0002-0673-5951"]},"institutions":[{"id":"https://openalex.org/I4210146472","display_name":"Ospedale Policlinico San Martino","ror":"https://ror.org/04d7es448","country_code":"IT","type":"healthcare","lineage":["https://openalex.org/I4210146472","https://openalex.org/I4210153126","https://openalex.org/I4405264730"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Maurizio Viale","raw_affiliation_strings":["IRCCS Azienda Ospedaliera Universitaria San Martino\u2014IST Istituto Nazionale per la Ricerca sul Cancro, U.O.C. Bioterapie, L.go R. Benzi, 10, Genova 16132, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"IRCCS Azienda Ospedaliera Universitaria San Martino\u2014IST Istituto Nazionale per la Ricerca sul Cancro, U.O.C. Bioterapie, L.go R. Benzi, 10, Genova 16132, Italy","institution_ids":["https://openalex.org/I4210146472"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5047663206","display_name":"Alberto Chiarini","orcid":"https://orcid.org/0000-0001-8388-7441","observed_orcids":["https://orcid.org/0000-0001-8388-7441"]},"institutions":[{"id":"https://openalex.org/I9360294","display_name":"University of Bologna","ror":"https://ror.org/01111rn36","country_code":"IT","type":"education","lineage":["https://openalex.org/I9360294"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Alberto Chiarini","raw_affiliation_strings":["Dipartimento di Farmacia e Biotecnologie, Alma Mater Studiorum-Universit\u00e0 di Bologna, Via Belmeloro 6, Bologna 40126, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Farmacia e Biotecnologie, Alma Mater Studiorum-Universit\u00e0 di Bologna, Via Belmeloro 6, Bologna 40126, Italy","institution_ids":["https://openalex.org/I9360294"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5026532639","display_name":"Emanuele Carosati","orcid":"https://orcid.org/0000-0003-0657-5035","observed_orcids":["https://orcid.org/0000-0003-0657-5035"]},"institutions":[{"id":"https://openalex.org/I27483092","display_name":"University of Perugia","ror":"https://ror.org/00x27da85","country_code":"IT","type":"education","lineage":["https://openalex.org/I27483092"]}],"countries":["IT"],"is_corresponding":true,"raw_author_name":"Emanuele Carosati","raw_affiliation_strings":["Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 di Perugia, Via Elce di Sotto 10, Perugia 06123, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Dipartimento di Chimica, Biologia e Biotecnologie, Universit\u00e0 di Perugia, Via Elce di Sotto 10, Perugia 06123, Italy","institution_ids":["https://openalex.org/I27483092"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":7,"corresponding_author_ids":["https://openalex.org/A5026532639","https://openalex.org/A5084691569"],"corresponding_institution_ids":["https://openalex.org/I27483092","https://openalex.org/I9360294"],"apc_list":{"value":2700,"currency":"CHF","value_usd":3258},"apc_paid":{"value":2700,"currency":"CHF","value_usd":3258},"fwci":0.5346,"has_fulltext":true,"cited_by_count":7,"citation_normalized_percentile":{"value":0.58177111,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":88,"max":95},"biblio":{"volume":"19","issue":"10","first_page":"16543","last_page":"16572"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T12410","display_name":"Structural and Chemical Analysis of Organic and Inorganic Compounds","score":0.35109999775886536,"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/T12410","display_name":"Structural and Chemical Analysis of Organic and Inorganic Compounds","score":0.35109999775886536,"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/T10211","display_name":"Computational Drug Discovery Methods","score":0.2515000104904175,"subfield":{"id":"https://openalex.org/subfields/3002","display_name":"Drug Discovery"},"field":{"id":"https://openalex.org/fields/30","display_name":"Pharmacology, Toxicology and Pharmaceutics"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T10274","display_name":"Heterocyclic Compound Synthesis and Bioactivity","score":0.20069999992847443,"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"}}],"keywords":[{"id":"https://openalex.org/keywords/l-type-calcium-channel-blockers","display_name":"L-type calcium channel blockers","score":0.7850000262260437},{"id":"https://openalex.org/keywords/p-glycoprotein-inhibitors","display_name":"P-glycoprotein inhibitors","score":0.9269999861717224},{"id":"https://openalex.org/keywords/3d-qsar","display_name":"3D-QSAR","score":0.9200000166893005},{"id":"https://openalex.org/keywords/virtual-screening","display_name":"virtual screening","score":0.6769999861717224},{"id":"https://openalex.org/keywords/pharmacophore","display_name":"pharmacophore","score":0.6320000290870667},{"id":"https://openalex.org/keywords/molecular-docking","display_name":"molecular docking","score":0.9229999780654907},{"id":"https://openalex.org/keywords/homology-model","display_name":"homology model","score":0.6859999895095825},{"id":"https://openalex.org/keywords/ternary-complex","display_name":"ternary complex","score":0.6100000143051147},{"id":"https://openalex.org/keywords/inotropic-effect","display_name":"inotropic effect","score":0.47600001096725464}],"concepts":[{"id":"https://openalex.org/C56173144","wikidata":"https://www.wikidata.org/wiki/Q1539893","display_name":"Pharmacophore","level":2,"score":0.9510107636451721},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.679119884967804},{"id":"https://openalex.org/C41685203","wikidata":"https://www.wikidata.org/wiki/Q1974042","display_name":"Docking (animal)","level":2,"score":0.6787731647491455},{"id":"https://openalex.org/C164126121","wikidata":"https://www.wikidata.org/wiki/Q766383","display_name":"Quantitative structure\u2013activity relationship","level":2,"score":0.6566283702850342},{"id":"https://openalex.org/C2775905019","wikidata":"https://www.wikidata.org/wiki/Q192572","display_name":"In silico","level":3,"score":0.5774399638175964},{"id":"https://openalex.org/C2776568683","wikidata":"https://www.wikidata.org/wiki/Q23005640","display_name":"Moiety","level":2,"score":0.5153495669364929},{"id":"https://openalex.org/C24530287","wikidata":"https://www.wikidata.org/wiki/Q424204","display_name":"Transmembrane protein","level":3,"score":0.4972591698169708},{"id":"https://openalex.org/C71240020","wikidata":"https://www.wikidata.org/wiki/Q186011","display_name":"Stereochemistry","level":1,"score":0.48491889238357544},{"id":"https://openalex.org/C21951064","wikidata":"https://www.wikidata.org/wiki/Q899212","display_name":"Combinatorial chemistry","level":1,"score":0.4688946604728699},{"id":"https://openalex.org/C85520022","wikidata":"https://www.wikidata.org/wiki/Q15322916","display_name":"Calcium channel","level":3,"score":0.4394567310810089},{"id":"https://openalex.org/C169627665","wikidata":"https://www.wikidata.org/wiki/Q5767913","display_name":"Homology modeling","level":3,"score":0.43832823634147644},{"id":"https://openalex.org/C519063684","wikidata":"https://www.wikidata.org/wiki/Q706","display_name":"Calcium","level":2,"score":0.3642500340938568},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.23896998167037964},{"id":"https://openalex.org/C170493617","wikidata":"https://www.wikidata.org/wiki/Q208467","display_name":"Receptor","level":2,"score":0.1559470295906067},{"id":"https://openalex.org/C181199279","wikidata":"https://www.wikidata.org/wiki/Q8047","display_name":"Enzyme","level":2,"score":0.08611735701560974},{"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/C159110408","wikidata":"https://www.wikidata.org/wiki/Q121176","display_name":"Nursing","level":1,"score":0.0},{"id":"https://openalex.org/C104317684","wikidata":"https://www.wikidata.org/wiki/Q7187","display_name":"Gene","level":2,"score":0.0},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.0}],"mesh":[{"descriptor_ui":"D000818","descriptor_name":"Animals","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D002121","descriptor_name":"Calcium Channel Blockers","qualifier_ui":"Q000138","qualifier_name":"chemical synthesis","is_major_topic":false},{"descriptor_ui":"D002121","descriptor_name":"Calcium Channel Blockers","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D006168","descriptor_name":"Guinea Pigs","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006325","descriptor_name":"Heart Atria","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":false},{"descriptor_ui":"D006571","descriptor_name":"Heterocyclic Compounds","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D009130","descriptor_name":"Muscle, Smooth","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":false},{"descriptor_ui":"D010069","descriptor_name":"Oxadiazoles","qualifier_ui":"Q000138","qualifier_name":"chemical synthesis","is_major_topic":true},{"descriptor_ui":"D010069","descriptor_name":"Oxadiazoles","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":true},{"descriptor_ui":"D018435","descriptor_name":"ATP Binding Cassette Transporter, Subfamily B","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D018435","descriptor_name":"ATP Binding Cassette Transporter, Subfamily B","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D021281","descriptor_name":"Quantitative Structure-Activity Relationship","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D040681","descriptor_name":"Structural Homology, Protein","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":12,"locations":[{"id":"doi:10.3390/molecules191016543","doi":"https://doi.org/10.3390/molecules191016543","is_oa":true,"landing_page_url":"http://dx.doi.org/10.3390/molecules191016543","pdf_url":"https://www.mdpi.com/1420-3049/19/10/16543/pdf?version=1413286811","source":{"id":"https://openalex.org/S108911230","display_name":"Molecules","issn_l":"1420-3049","issn":["1420-3049","1433-1373"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["anvur-scientific","cwts-core","doaj","medline","poland-140","russia-white-list-1"],"host_organization":"https://openalex.org/P4310310987","host_organization_name":"Multidisciplinary Digital Publishing Institute","host_organization_lineage":["https://openalex.org/P4310310987"],"host_organization_lineage_names":["Multidisciplinary Digital Publishing Institute"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Molecules","raw_type":"journal-article"},{"id":"pmh:oai:europepmc.org:5276057","doi":null,"is_oa":true,"landing_page_url":"https://www.ncbi.nlm.nih.gov/pmc/articles/6271282","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,"listed_in":[],"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":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":null,"raw_type":"Text"},{"id":"pmid:25317581","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/25317581","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,"listed_in":[],"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":"Molecules (Basel, Switzerland)","raw_type":"Journal Article"},{"id":"pmh:oai:pubmedcentral.nih.gov:6271282","doi":null,"is_oa":true,"landing_page_url":"https://pmc.ncbi.nlm.nih.gov/articles/PMC6271282/","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,"listed_in":[],"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":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Molecules","raw_type":"Text"},{"id":"pmh:oai:CiteSeerX.psu:10.1.1.655.8377","doi":null,"is_oa":false,"landing_page_url":"http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.655.8377","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"http://www.mdpi.com/1420-3049/19/10/16543/pdf/","raw_type":"text"},{"id":"pmh:oai:arts.units.it:11368/3026544","doi":null,"is_oa":false,"landing_page_url":"http://hdl.handle.net/11368/3026544","pdf_url":null,"source":{"id":"https://openalex.org/S4306400480","display_name":"ArTS Archivio della ricerca di Trieste (University of Trieste https://www.units.it/)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I142444530","host_organization_name":"University of Trieste","host_organization_lineage":["https://openalex.org/I142444530"],"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"},{"id":"pmh:oai:cris.unibo.it:11585/517573","doi":null,"is_oa":false,"landing_page_url":"http://hdl.handle.net/11585/517573","pdf_url":null,"source":{"id":"https://openalex.org/S4306402579","display_name":"Archivio istituzionale della ricerca (Alma Mater Studiorum Universit\u00e0 di Bologna)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I4210117483","host_organization_name":"Istituto di Ematologia di Bologna","host_organization_lineage":["https://openalex.org/I4210117483"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"","raw_type":"info:eu-repo/semantics/article"},{"id":"pmh:oai:doaj.org/article:ddf26899b337451bb7cef0ca2fc0bb1d","doi":null,"is_oa":true,"landing_page_url":"https://doaj.org/article/ddf26899b337451bb7cef0ca2fc0bb1d","pdf_url":null,"source":{"id":"https://openalex.org/S4306401280","display_name":"DOAJ (DOAJ: Directory of Open Access Journals)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by-sa","license_id":"https://openalex.org/licenses/cc-by-sa","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Molecules, Vol 19, Iss 10, Pp 16543-16572 (2014)","raw_type":"article"},{"id":"pmh:oai:flore.unifi.it:2158/1000407","doi":null,"is_oa":false,"landing_page_url":"http://hdl.handle.net/2158/1000407","pdf_url":null,"source":{"id":"https://openalex.org/S4306402033","display_name":"Florence Research (University of Florence)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I45084792","host_organization_name":"University of Florence","host_organization_lineage":["https://openalex.org/I45084792"],"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"},{"id":"pmh:oai:ora.uniurb.it:11576/2696050","doi":null,"is_oa":true,"landing_page_url":"https://www.mdpi.com/1420-3049/19/10/16543","pdf_url":null,"source":{"id":"https://openalex.org/S4377196377","display_name":"CINECA IRIS Institutional Research information system (University of Urbino)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I190397597","host_organization_name":"University of Urbino","host_organization_lineage":["https://openalex.org/I190397597"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"info:eu-repo/semantics/article"},{"id":"pmh:oai:usiena-air.unisi.it:11365/48242","doi":null,"is_oa":false,"landing_page_url":"http://hdl.handle.net/11365/48242","pdf_url":null,"source":{"id":"https://openalex.org/S4377196319","display_name":"Use Siena air (University of Siena)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I102064193","host_organization_name":"University of Siena","host_organization_lineage":["https://openalex.org/I102064193"],"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"},{"id":"mag:3179642270","doi":null,"is_oa":false,"landing_page_url":"https://jglobal.jst.go.jp/detail?JGLOBAL_ID=201502231254986675","pdf_url":null,"source":{"id":"https://openalex.org/S4306520156","display_name":"Molecules (Web)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"journal"},"license":null,"license_id":null,"version":null,"is_accepted":false,"is_published":false,"raw_source_name":"Molecules (Web)","raw_type":null}],"best_oa_location":{"id":"doi:10.3390/molecules191016543","doi":"https://doi.org/10.3390/molecules191016543","is_oa":true,"landing_page_url":"http://dx.doi.org/10.3390/molecules191016543","pdf_url":"https://www.mdpi.com/1420-3049/19/10/16543/pdf?version=1413286811","source":{"id":"https://openalex.org/S108911230","display_name":"Molecules","issn_l":"1420-3049","issn":["1420-3049","1433-1373"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["anvur-scientific","cwts-core","doaj","medline","poland-140","russia-white-list-1"],"host_organization":"https://openalex.org/P4310310987","host_organization_name":"Multidisciplinary Digital Publishing Institute","host_organization_lineage":["https://openalex.org/P4310310987"],"host_organization_lineage_names":["Multidisciplinary Digital Publishing Institute"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Molecules","raw_type":"journal-article"},"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[{"id":"https://openalex.org/F4320321873","display_name":"Ministero dell\u2019Istruzione, dell\u2019Universit\u00e0 e della Ricerca","ror":"https://ror.org/0166hxq48"},{"id":"https://openalex.org/F4320323553","display_name":"Universit\u00e0 di Bologna","ror":"https://ror.org/01111rn36"}],"has_content":{"grobid_xml":true,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W1976802454.pdf","grobid_xml":"https://content.openalex.org/works/W1976802454.grobid-xml"},"referenced_works_count":54,"referenced_works":["https://openalex.org/W1496902535","https://openalex.org/W1508421599","https://openalex.org/W1535912510","https://openalex.org/W1899877571","https://openalex.org/W1981363747","https://openalex.org/W1982191861","https://openalex.org/W1989741213","https://openalex.org/W1993896317","https://openalex.org/W1996966884","https://openalex.org/W1997511216","https://openalex.org/W1998952692","https://openalex.org/W2006073707","https://openalex.org/W2006536234","https://openalex.org/W2009667219","https://openalex.org/W2013831058","https://openalex.org/W2015426350","https://openalex.org/W2017719949","https://openalex.org/W2022289005","https://openalex.org/W2023136543","https://openalex.org/W2031351884","https://openalex.org/W2031545704","https://openalex.org/W2038317858","https://openalex.org/W2039388338","https://openalex.org/W2039793500","https://openalex.org/W2039870867","https://openalex.org/W2040466299","https://openalex.org/W2043835726","https://openalex.org/W2044638382","https://openalex.org/W2046462944","https://openalex.org/W2049014112","https://openalex.org/W2055513711","https://openalex.org/W2058895782","https://openalex.org/W2060109945","https://openalex.org/W2065283382","https://openalex.org/W2069764649","https://openalex.org/W2070756053","https://openalex.org/W2075518903","https://openalex.org/W2089619661","https://openalex.org/W2112784595","https://openalex.org/W2122199548","https://openalex.org/W2132629607","https://openalex.org/W2134203509","https://openalex.org/W2141226131","https://openalex.org/W2152669108","https://openalex.org/W2164492968","https://openalex.org/W2180403979","https://openalex.org/W2204075485","https://openalex.org/W2950353808","https://openalex.org/W2951578709","https://openalex.org/W2952925191","https://openalex.org/W4214824545","https://openalex.org/W4236896953","https://openalex.org/W4241301928","https://openalex.org/W4388366760"],"related_works":["https://openalex.org/W7100010758","https://openalex.org/W1989741213","https://openalex.org/W2031351884","https://openalex.org/W2004587361","https://openalex.org/W1972421951","https://openalex.org/W2800879395","https://openalex.org/W2043835726","https://openalex.org/W4220760283","https://openalex.org/W2000242696","https://openalex.org/W1897189117"],"abstract_inverted_index":{"As":[0],"a":[1,12,36,50,77,88,114,144,159],"result":[2],"of":[3,7,61,99,113,133,140,147,162,170,179],"the":[4,45,59,65,93,97,105,111,118,120,124,138,141,148,156,177],"ring-into-ring":[5],"conversion":[6],"nitrosoimidazole":[8],"derivatives,":[9,74],"we":[10,30,43,57,109],"obtained":[11],"molecular":[13],"scaffold":[14,33,181],"that,":[15],"when":[16],"properly":[17],"decorated,":[18],"is":[19,165],"able":[20],"to":[21,34],"decrease":[22],"inotropy":[23],"by":[24,92,131,167],"blocking":[25],"L-type":[26],"calcium":[27,102],"channels.":[28],"Previously,":[29],"used":[31,44],"this":[32,129,168,180],"develop":[35,76],"quantitative":[37],"structure-activity":[38],"relationship":[39],"(QSAR)":[40],"model,":[41],"and":[42,67,75,123,136,172],"most":[46],"potent":[47],"oxadiazolothiazinone":[48],"as":[49],"template":[51],"for":[52,71],"ligand-based":[53],"virtual":[54],"screening.":[55],"Here,":[56],"enlarge":[58],"diversity":[60],"chemical":[62],"decorations,":[63],"present":[64],"synthesis":[66],"in":[68,83,104,182],"vitro":[69],"data":[70],"11":[72],"new":[73,78],"3D-QSAR":[79],"model":[80,146,161],"with":[81,153,158],"recent":[82],"silico":[84],"techniques.":[85],"We":[86,126,150],"observed":[87],"key":[89],"role":[90],"played":[91],"oxadiazolone":[94],"moiety:":[95],"given":[96],"presence":[98],"positively":[100],"charged":[101],"ions":[103],"transmembrane":[106],"channel":[107],"protein,":[108],"hypothesize":[110],"formation":[112],"ternary":[115],"complex":[116],"between":[117],"oxadiazolothiazinone,":[119],"Ca2+":[121],"ion":[122],"protein.":[125,149],"have":[127],"supported":[128],"hypothesis":[130],"means":[132],"pharmacophore":[134,142],"generation":[135],"through":[137],"docking":[139,154],"into":[143],"homology":[145,160],"also":[151],"studied":[152],"experiments":[155],"interaction":[157],"P-glycoprotein,":[163],"which":[164],"inhibited":[166],"series":[169],"molecules,":[171],"provided":[173],"further":[174],"evidence":[175],"toward":[176],"relevance":[178],"biological":[183],"interactions.":[184]},"counts_by_year":[{"year":2025,"cited_by_count":1},{"year":2024,"cited_by_count":1},{"year":2020,"cited_by_count":2},{"year":2017,"cited_by_count":1},{"year":2016,"cited_by_count":1},{"year":2015,"cited_by_count":1}],"updated_date":"2026-11-10T11:39:43.021295","created_date":"2016-06-24T00:00:00"}