{"id":"https://openalex.org/W7211932001","doi":"https://doi.org/10.1016/j.bioorg.2026.110459","title":"Chalcone-based synthesis of a new Pyrazoline derivative: Molecular docking and anthelmintic evaluation against Schistosoma mansoni","display_name":"Chalcone-based synthesis of a new Pyrazoline derivative: Molecular docking and anthelmintic evaluation against Schistosoma mansoni","publication_year":2026,"publication_date":"2026-09-08","ids":{"openalex":"https://openalex.org/W7211932001","doi":"https://doi.org/10.1016/j.bioorg.2026.110459","pmid":"https://pubmed.ncbi.nlm.nih.gov/42753607"},"language":"en","primary_location":{"id":"doi:10.1016/j.bioorg.2026.110459","doi":"https://doi.org/10.1016/j.bioorg.2026.110459","is_oa":true,"landing_page_url":"https://doi.org/10.1016/j.bioorg.2026.110459","pdf_url":null,"source":{"id":"https://openalex.org/S165482960","display_name":"Bioorganic Chemistry","issn_l":"0045-2068","issn":["0045-2068","1090-2120"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-b","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-1"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Bioorganic Chemistry","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref","pubmed"],"open_access":{"is_oa":true,"oa_status":"hybrid","oa_url":"https://doi.org/10.1016/j.bioorg.2026.110459","any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5057071592","display_name":"Andr\u00e9 Luis Kerek","orcid":"https://orcid.org/0000-0002-5449-3619","observed_orcids":["https://orcid.org/0000-0002-5449-3619"]},"institutions":[{"id":"https://openalex.org/I68207295","display_name":"Universidade Estadual de Ponta Grossa","ror":"https://ror.org/027s08w94","country_code":"BR","type":"education","lineage":["https://openalex.org/I68207295"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Andr\u00e9 L. Kerek","raw_affiliation_strings":["Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil","institution_ids":["https://openalex.org/I68207295"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5138281645","display_name":"Eduardo Protachevicz","orcid":"https://orcid.org/0000-0002-2779-8951","observed_orcids":["https://orcid.org/0000-0002-2779-8951"]},"institutions":[{"id":"https://openalex.org/I68207295","display_name":"Universidade Estadual de Ponta Grossa","ror":"https://ror.org/027s08w94","country_code":"BR","type":"education","lineage":["https://openalex.org/I68207295"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Eduardo Protachevicz","raw_affiliation_strings":["Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil","institution_ids":["https://openalex.org/I68207295"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5150788517","display_name":"Anna F.M. de Souza","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I181391015","display_name":"Universidade Estadual de Campinas (UNICAMP)","ror":"https://ror.org/04wffgt70","country_code":"BR","type":"education","lineage":["https://openalex.org/I181391015"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Anna F.M. de Souza","raw_affiliation_strings":["Department of Parasitology, State University of Campinas, Monteiro Lobato Street, 255, CEP - 13083-862, Campinas, S\u00e3o Paulo, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Parasitology, State University of Campinas, Monteiro Lobato Street, 255, CEP - 13083-862, Campinas, S\u00e3o Paulo, Brazil","institution_ids":["https://openalex.org/I181391015"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5033042088","display_name":"Larissa Sens","orcid":"https://orcid.org/0000-0003-2404-3817","observed_orcids":["https://orcid.org/0000-0003-2404-3817"]},"institutions":[{"id":"https://openalex.org/I4210160371","display_name":"Instituto Federal do Esp\u00edrito Santo","ror":"https://ror.org/05rshs160","country_code":"BR","type":"funder","lineage":["https://openalex.org/I4210160371"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Larissa Sens","raw_affiliation_strings":["Federal Institute of Esp\u00edrito Santo, Rio Branco Avenue, 50, CEP - 29056-264, Vit\u00f3ria, Esp\u00edrito Santo, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Federal Institute of Esp\u00edrito Santo, Rio Branco Avenue, 50, CEP - 29056-264, Vit\u00f3ria, Esp\u00edrito Santo, Brazil","institution_ids":["https://openalex.org/I4210160371"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5033377752","display_name":"Marilei Casturina Mendes Sandri","orcid":"https://orcid.org/0000-0003-0076-5364","observed_orcids":["https://orcid.org/0000-0003-0076-5364"]},"institutions":[{"id":"https://openalex.org/I68207295","display_name":"Universidade Estadual de Ponta Grossa","ror":"https://ror.org/027s08w94","country_code":"BR","type":"education","lineage":["https://openalex.org/I68207295"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Marilei C.M. Sandri","raw_affiliation_strings":["Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil","institution_ids":["https://openalex.org/I68207295"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5007213666","display_name":"Adrielle Cristina dos Reis","orcid":"https://orcid.org/0000-0001-8327-1268","observed_orcids":["https://orcid.org/0000-0001-8327-1268"]},"institutions":[{"id":"https://openalex.org/I68207295","display_name":"Universidade Estadual de Ponta Grossa","ror":"https://ror.org/027s08w94","country_code":"BR","type":"education","lineage":["https://openalex.org/I68207295"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Adrielle C. dos Reis","raw_affiliation_strings":["Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil","institution_ids":["https://openalex.org/I68207295"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5058097788","display_name":"K\u00e1tia Sabrina Paludo","orcid":"https://orcid.org/0000-0003-2248-5881","observed_orcids":["https://orcid.org/0000-0003-2248-5881"]},"institutions":[{"id":"https://openalex.org/I68207295","display_name":"Universidade Estadual de Ponta Grossa","ror":"https://ror.org/027s08w94","country_code":"BR","type":"education","lineage":["https://openalex.org/I68207295"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Katia S. Paludo","raw_affiliation_strings":["Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil","institution_ids":["https://openalex.org/I68207295"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5051698131","display_name":"Fl\u00e1vio Augusto Vicente Seixas","orcid":"https://orcid.org/0000-0002-0117-6919","observed_orcids":["https://orcid.org/0000-0002-0117-6919"]},"institutions":[{"id":"https://openalex.org/I123443094","display_name":"Universidade Estadual de Maring\u00e1","ror":"https://ror.org/04bqqa360","country_code":"BR","type":"education","lineage":["https://openalex.org/I123443094"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Fl\u00e1vio A.V. Seixas","raw_affiliation_strings":["Department of Tecnology, State University of Maring\u00e1 - Umuarama Campus, Av. Colombo Avenue, 5790, CEP - 87020-900, Umuarama, Paran\u00e1, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Tecnology, State University of Maring\u00e1 - Umuarama Campus, Av. Colombo Avenue, 5790, CEP - 87020-900, Umuarama, Paran\u00e1, Brazil","institution_ids":["https://openalex.org/I123443094"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5039368204","display_name":"Adriano Gon\u00e7alves Viana","orcid":"https://orcid.org/0000-0002-9978-8058","observed_orcids":["https://orcid.org/0000-0002-9978-8058"]},"institutions":[{"id":"https://openalex.org/I68207295","display_name":"Universidade Estadual de Ponta Grossa","ror":"https://ror.org/027s08w94","country_code":"BR","type":"education","lineage":["https://openalex.org/I68207295"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Adriano G. Viana","raw_affiliation_strings":["Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil","institution_ids":["https://openalex.org/I68207295"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5150775464","display_name":"Rosimeire N. de Oliveira","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I181391015","display_name":"Universidade Estadual de Campinas (UNICAMP)","ror":"https://ror.org/04wffgt70","country_code":"BR","type":"education","lineage":["https://openalex.org/I181391015"]},{"id":"https://openalex.org/I68207295","display_name":"Universidade Estadual de Ponta Grossa","ror":"https://ror.org/027s08w94","country_code":"BR","type":"education","lineage":["https://openalex.org/I68207295"]}],"countries":["BR"],"is_corresponding":true,"raw_author_name":"Rosimeire N. de Oliveira","raw_affiliation_strings":["Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil; Department of Parasitology, State University of Campinas, Monteiro Lobato Street, 255, CEP - 13083-862, Campinas, S\u00e3o Paulo, Brazil. Electronic address: rnoliveira@uepg.br"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil; Department of Parasitology, State University of Campinas, Monteiro Lobato Street, 255, CEP - 13083-862, Campinas, S\u00e3o Paulo, Brazil. Electronic address: rnoliveira@uepg.br","institution_ids":["https://openalex.org/I181391015","https://openalex.org/I68207295"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5086189459","display_name":"Silmara Marques Allegretti","orcid":"https://orcid.org/0000-0003-4975-3663","observed_orcids":["https://orcid.org/0000-0003-4975-3663"]},"institutions":[{"id":"https://openalex.org/I181391015","display_name":"Universidade Estadual de Campinas (UNICAMP)","ror":"https://ror.org/04wffgt70","country_code":"BR","type":"education","lineage":["https://openalex.org/I181391015"]}],"countries":["BR"],"is_corresponding":true,"raw_author_name":"Silmara M. Allegretti","raw_affiliation_strings":["Department of Parasitology, State University of Campinas, Monteiro Lobato Street, 255, CEP - 13083-862, Campinas, S\u00e3o Paulo, Brazil. Electronic address: sallegre@unicamp.br"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Parasitology, State University of Campinas, Monteiro Lobato Street, 255, CEP - 13083-862, Campinas, S\u00e3o Paulo, Brazil. Electronic address: sallegre@unicamp.br","institution_ids":["https://openalex.org/I181391015"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5009324183","display_name":"B\u00e1rbara C. Fiorin","orcid":"https://orcid.org/0000-0002-2994-7324","observed_orcids":["https://orcid.org/0000-0002-2994-7324"]},"institutions":[{"id":"https://openalex.org/I68207295","display_name":"Universidade Estadual de Ponta Grossa","ror":"https://ror.org/027s08w94","country_code":"BR","type":"education","lineage":["https://openalex.org/I68207295"]}],"countries":["BR"],"is_corresponding":true,"raw_author_name":"Barbara C. Fiorin","raw_affiliation_strings":["Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil. Electronic address: bcfiorin@uepg.br"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, State University of Ponta Grossa, General Carlos Cavalcanti Avenue, 4748, CEP - 84030-900, Ponta Grossa, Paran\u00e1, Brazil. Electronic address: bcfiorin@uepg.br","institution_ids":["https://openalex.org/I68207295"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":4,"corresponding_author_ids":["https://openalex.org/A5009324183","https://openalex.org/A5086189459","https://openalex.org/A5150775464"],"corresponding_institution_ids":["https://openalex.org/I181391015","https://openalex.org/I68207295"],"apc_list":{"value":4240,"currency":"USD","value_usd":4240},"apc_paid":{"value":4240,"currency":"USD","value_usd":4240},"fwci":0.0,"has_fulltext":false,"cited_by_count":0,"citation_normalized_percentile":{"value":0.63080895,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"182","issue":null,"first_page":"110459","last_page":"110459"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10695","display_name":"Parasites and Host Interactions","score":0.5375999808311462,"subfield":{"id":"https://openalex.org/subfields/2405","display_name":"Parasitology"},"field":{"id":"https://openalex.org/fields/24","display_name":"Immunology and Microbiology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},"topics":[{"id":"https://openalex.org/T10695","display_name":"Parasites and Host Interactions","score":0.5375999808311462,"subfield":{"id":"https://openalex.org/subfields/2405","display_name":"Parasitology"},"field":{"id":"https://openalex.org/fields/24","display_name":"Immunology and Microbiology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T10274","display_name":"Heterocyclic Compound Synthesis and Bioactivity","score":0.38769999146461487,"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/T14099","display_name":"Synthesis and Characterization of Heterocyclic Compounds","score":0.011500000022351742,"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/chalcone-derivatives","display_name":"chalcone derivatives","score":0.878000020980835},{"id":"https://openalex.org/keywords/pyrazoline-derivatives","display_name":"pyrazoline derivatives","score":0.9700000286102295},{"id":"https://openalex.org/keywords/schistosoma-mansoni","display_name":"Schistosoma mansoni","score":0.9940000176429749},{"id":"https://openalex.org/keywords/schistosomicidal-activity","display_name":"schistosomicidal activity","score":0.9480000138282776},{"id":"https://openalex.org/keywords/anthelmintics","display_name":"anthelmintics","score":0.8989999890327454},{"id":"https://openalex.org/keywords/cathepsin-b","display_name":"cathepsin B","score":0.8920000195503235},{"id":"https://openalex.org/keywords/thioredoxin-glutathione-reductase","display_name":"thioredoxin glutathione reductase","score":0.9210000038146973},{"id":"https://openalex.org/keywords/beta-tubulin","display_name":"beta-tubulin","score":0.9279999732971191},{"id":"https://openalex.org/keywords/molecular-docking","display_name":"molecular docking","score":0.5789999961853027},{"id":"https://openalex.org/keywords/admet-prediction","display_name":"ADMET prediction","score":0.8629999756813049},{"id":"https://openalex.org/keywords/parasite-motility","display_name":"parasite motility","score":0.6809999942779541}],"concepts":[{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.7796000242233276},{"id":"https://openalex.org/C2776863245","wikidata":"https://www.wikidata.org/wiki/Q2324689","display_name":"Schistosoma mansoni","level":4,"score":0.7224000096321106},{"id":"https://openalex.org/C2780764945","wikidata":"https://www.wikidata.org/wiki/Q899416","display_name":"Chalcone","level":2,"score":0.6851000189781189},{"id":"https://openalex.org/C2780744904","wikidata":"https://www.wikidata.org/wiki/Q7263415","display_name":"Pyrazoline","level":2,"score":0.6521000266075134},{"id":"https://openalex.org/C202751555","wikidata":"https://www.wikidata.org/wiki/Q221681","display_name":"In vitro","level":2,"score":0.506600022315979},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.49970000982284546},{"id":"https://openalex.org/C116073593","wikidata":"https://www.wikidata.org/wiki/Q864491","display_name":"Biological activity","level":3,"score":0.4839000105857849},{"id":"https://openalex.org/C41685203","wikidata":"https://www.wikidata.org/wiki/Q1974042","display_name":"Docking (animal)","level":2,"score":0.4311999976634979},{"id":"https://openalex.org/C71240020","wikidata":"https://www.wikidata.org/wiki/Q186011","display_name":"Stereochemistry","level":1,"score":0.39809998869895935},{"id":"https://openalex.org/C538909803","wikidata":"https://www.wikidata.org/wiki/Q116907","display_name":"Glutathione","level":3,"score":0.37540000677108765},{"id":"https://openalex.org/C2776635100","wikidata":"https://www.wikidata.org/wiki/Q582559","display_name":"Antiprotozoal","level":3,"score":0.3549000024795532},{"id":"https://openalex.org/C98274493","wikidata":"https://www.wikidata.org/wiki/Q128406","display_name":"Pharmacology","level":1,"score":0.3488999903202057},{"id":"https://openalex.org/C178910836","wikidata":"https://www.wikidata.org/wiki/Q2196961","display_name":"Molecular model","level":2,"score":0.32199999690055847},{"id":"https://openalex.org/C173633252","wikidata":"https://www.wikidata.org/wiki/Q3663475","display_name":"Cathepsin D","level":3,"score":0.3158999979496002},{"id":"https://openalex.org/C2777737464","wikidata":"https://www.wikidata.org/wiki/Q2540636","display_name":"Thioredoxin reductase","level":4,"score":0.3127000033855438},{"id":"https://openalex.org/C2776908094","wikidata":"https://www.wikidata.org/wiki/Q572294","display_name":"Anthelmintic","level":2,"score":0.3021000027656555},{"id":"https://openalex.org/C2779744950","wikidata":"https://www.wikidata.org/wiki/Q424145","display_name":"Praziquantel","level":4,"score":0.2955999970436096},{"id":"https://openalex.org/C207001950","wikidata":"https://www.wikidata.org/wiki/Q141124","display_name":"In vivo","level":2,"score":0.28859999775886536},{"id":"https://openalex.org/C3623737","wikidata":"https://www.wikidata.org/wiki/Q421219","display_name":"Thioredoxin","level":3,"score":0.28769999742507935},{"id":"https://openalex.org/C2781320022","wikidata":"https://www.wikidata.org/wiki/Q417149","display_name":"Dihydrofolate reductase","level":3,"score":0.2856999933719635},{"id":"https://openalex.org/C33618052","wikidata":"https://www.wikidata.org/wiki/Q6013136","display_name":"In vitro toxicology","level":3,"score":0.2793999910354614},{"id":"https://openalex.org/C167844969","wikidata":"https://www.wikidata.org/wiki/Q426245","display_name":"Cathepsin","level":3,"score":0.27219998836517334},{"id":"https://openalex.org/C111771559","wikidata":"https://www.wikidata.org/wiki/Q66295","display_name":"Derivative (finance)","level":2,"score":0.26739999651908875},{"id":"https://openalex.org/C181199279","wikidata":"https://www.wikidata.org/wiki/Q8047","display_name":"Enzyme","level":2,"score":0.26010000705718994},{"id":"https://openalex.org/C193042331","wikidata":"https://www.wikidata.org/wiki/Q1772003","display_name":"Structure\u2013activity relationship","level":3,"score":0.2583000063896179},{"id":"https://openalex.org/C58207958","wikidata":"https://www.wikidata.org/wiki/Q33596","display_name":"Motility","level":2,"score":0.25760000944137573},{"id":"https://openalex.org/C133571119","wikidata":"https://www.wikidata.org/wiki/Q899102","display_name":"Circular dichroism","level":2,"score":0.2524999976158142},{"id":"https://openalex.org/C2778491710","wikidata":"https://www.wikidata.org/wiki/Q1457418","display_name":"Schistosoma","level":5,"score":0.2524000108242035},{"id":"https://openalex.org/C2779149719","wikidata":"https://www.wikidata.org/wiki/Q682252","display_name":"PEGylation","level":3,"score":0.251800000667572},{"id":"https://openalex.org/C74187038","wikidata":"https://www.wikidata.org/wiki/Q1418791","display_name":"Drug discovery","level":2,"score":0.25040000677108765}],"mesh":[{"descriptor_ui":"D000818","descriptor_name":"Animals","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000871","descriptor_name":"Anthelmintics","qualifier_ui":"Q000138","qualifier_name":"chemical synthesis","is_major_topic":true},{"descriptor_ui":"D000871","descriptor_name":"Anthelmintics","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":true},{"descriptor_ui":"D000871","descriptor_name":"Anthelmintics","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D004305","descriptor_name":"Dose-Response Relationship, Drug","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D005260","descriptor_name":"Female","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011720","descriptor_name":"Pyrazoles","qualifier_ui":"Q000138","qualifier_name":"chemical synthesis","is_major_topic":true},{"descriptor_ui":"D011720","descriptor_name":"Pyrazoles","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":true},{"descriptor_ui":"D011720","descriptor_name":"Pyrazoles","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D012550","descriptor_name":"Schistosoma mansoni","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":true},{"descriptor_ui":"D013329","descriptor_name":"Structure-Activity Relationship","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D015394","descriptor_name":"Molecular Structure","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D021261","descriptor_name":"Parasitic Sensitivity Tests","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D047188","descriptor_name":"Chalcones","qualifier_ui":"Q000138","qualifier_name":"chemical synthesis","is_major_topic":true},{"descriptor_ui":"D047188","descriptor_name":"Chalcones","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":true},{"descriptor_ui":"D047188","descriptor_name":"Chalcones","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D062105","descriptor_name":"Molecular Docking Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true}],"locations_count":2,"locations":[{"id":"doi:10.1016/j.bioorg.2026.110459","doi":"https://doi.org/10.1016/j.bioorg.2026.110459","is_oa":true,"landing_page_url":"https://doi.org/10.1016/j.bioorg.2026.110459","pdf_url":null,"source":{"id":"https://openalex.org/S165482960","display_name":"Bioorganic Chemistry","issn_l":"0045-2068","issn":["0045-2068","1090-2120"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-b","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-1"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Bioorganic Chemistry","raw_type":"journal-article"},{"id":"pmid:42753607","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/42753607","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":"Bioorganic chemistry","raw_type":"Journal Article"}],"best_oa_location":{"id":"doi:10.1016/j.bioorg.2026.110459","doi":"https://doi.org/10.1016/j.bioorg.2026.110459","is_oa":true,"landing_page_url":"https://doi.org/10.1016/j.bioorg.2026.110459","pdf_url":null,"source":{"id":"https://openalex.org/S165482960","display_name":"Bioorganic Chemistry","issn_l":"0045-2068","issn":["0045-2068","1090-2120"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-b","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-1"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Bioorganic Chemistry","raw_type":"journal-article"},"sustainable_development_goals":[{"display_name":"Good health and well-being","id":"https://metadata.un.org/sdg/3","score":0.8371999859809875}],"study_designs":[],"awards":[{"id":"https://openalex.org/G2593790673","display_name":null,"funder_award_id":"310700/2023-0 PQ-Produtividade","funder_id":"https://openalex.org/F4320322025","funder_display_name":"Conselho Nacional de Desenvolvimento Cient\u00edfico e Tecnol\u00f3gico"}],"funders":[{"id":"https://openalex.org/F4320321091","display_name":"Coordena\u00e7\u00e3o de Aperfei\u00e7oamento de Pessoal de N\u00edvel Superior","ror":"https://ror.org/00x0ma614"},{"id":"https://openalex.org/F4320322025","display_name":"Conselho Nacional de Desenvolvimento Cient\u00edfico e Tecnol\u00f3gico","ror":"https://ror.org/03swz6y49"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":51,"referenced_works":["https://openalex.org/W262205220","https://openalex.org/W770563939","https://openalex.org/W778585144","https://openalex.org/W1016773569","https://openalex.org/W1927495877","https://openalex.org/W1986638363","https://openalex.org/W2009688070","https://openalex.org/W2014103163","https://openalex.org/W2049493521","https://openalex.org/W2050389758","https://openalex.org/W2051635559","https://openalex.org/W2055423985","https://openalex.org/W2080961736","https://openalex.org/W2094190961","https://openalex.org/W2099941718","https://openalex.org/W2115491202","https://openalex.org/W2131096147","https://openalex.org/W2171068265","https://openalex.org/W2606632260","https://openalex.org/W2766262574","https://openalex.org/W2895471138","https://openalex.org/W2912174608","https://openalex.org/W2918014866","https://openalex.org/W2949976809","https://openalex.org/W2996165122","https://openalex.org/W3012401060","https://openalex.org/W3014107563","https://openalex.org/W3039763623","https://openalex.org/W3047491523","https://openalex.org/W3082803849","https://openalex.org/W3095669917","https://openalex.org/W3189338891","https://openalex.org/W3195683163","https://openalex.org/W3214389223","https://openalex.org/W4200207022","https://openalex.org/W4200526355","https://openalex.org/W4213214197","https://openalex.org/W4229050629","https://openalex.org/W4237047941","https://openalex.org/W4366602290","https://openalex.org/W4386319754","https://openalex.org/W4388450751","https://openalex.org/W4390976288","https://openalex.org/W4391033607","https://openalex.org/W4391522231","https://openalex.org/W4393151705","https://openalex.org/W4394746672","https://openalex.org/W4399174021","https://openalex.org/W4400556514","https://openalex.org/W4416822338","https://openalex.org/W7133326799"],"related_works":["https://openalex.org/W4406352213","https://openalex.org/W2895471138","https://openalex.org/W4200526355","https://openalex.org/W4244715544","https://openalex.org/W7202254731","https://openalex.org/W4213214197","https://openalex.org/W2792892919","https://openalex.org/W4406352171","https://openalex.org/W4412956105","https://openalex.org/W2605261590"],"abstract_inverted_index":{"Chalcones":[0],"and":[1,34,49,69,87,111,123,141,152,168,179,186,196,205,220,237],"their":[2,16],"derivatives":[3],"have":[4],"attracted":[5],"considerable":[6],"interest":[7],"in":[8,26,116,131,183],"drug":[9],"discovery":[10],"due":[11],"to":[12,76],"literature":[13],"reports":[14],"describing":[15],"diverse":[17],"biological":[18,200],"activities.":[19],"In":[20,189],"this":[21],"study,":[22],"we":[23],"evaluated":[24],"the":[25,61,136,191,208,214,224],"vitro":[27,132],"schistosomicidal":[28,137],"activity":[29,138],"of":[30,93,101,139,207],"a":[31],"chalcone":[32,45],"derivative":[33,38,54,227],"its":[35,50],"corresponding":[36],"pyrazoline":[37,53,226],"against":[39],"adult":[40],"Schistosoma":[41],"mansoni":[42,118,210],"worms.":[43,188],"The":[44],"(":[46,55],"1a":[47,140,219],")":[48],"newly":[51],"synthesized":[52],"1b":[56,142,221,228],"),":[57],"reported":[58],"here":[59],"for":[60,234],"first":[62],"time,":[63],"showed":[64],"generally":[65],"favorable":[66,99],"predicted":[67,75,98],"pharmacokinetic":[68],"ADMET":[70],"profiles.":[71],"Both":[72],"compounds":[73,156,192,218],"were":[74],"exhibit":[77],"high":[78],"gastrointestinal":[79],"absorption":[80],"(GIA),":[81],"suitable":[82],"blood-brain":[83],"barrier":[84],"(BBB)":[85],"permeability,":[86],"full":[88],"compliance":[89],"with":[90,104,120,203],"Lipinski's":[91],"rule":[92],"five.":[94],"Molecular":[95],"docking":[96,121],"analyses":[97],"interactions":[100],"both":[102,155,184],"molecules":[103],"Cathepsin":[105],"B,":[106],"Thioredoxin":[107],"Glutathione":[108],"Reductase":[109],"(TGR),":[110],"\u03b2-tubulin,":[112],"biologically":[113],"relevant":[114],"proteins":[115],"S.":[117,209],",":[119,222,229],"scores":[122],"interaction":[124],"profiles":[125],"supporting":[126],"plausible":[127],"ligand-target":[128],"recognition.":[129],"Complementary":[130],"assays":[133],"further":[134,235],"supported":[135],"through":[143],"phenotypic":[144],"analysis,":[145],"revealing":[146],"marked":[147],"effects":[148],"on":[149],"parasite":[150,177],"viability":[151],"morphology.":[153],"Notably,":[154],"induced":[157],"100.0%":[158],"mortality":[159],"at":[160,170],"20.0":[161],"\u03bcg":[162,172],"mL":[163,173],"\u22121":[164,174],"within":[165],"24":[166],"h,":[167],"even":[169],"5.0":[171],"they":[175],"reduced":[176],"motility":[178],"caused":[180],"morphological":[181],"alterations":[182],"male":[185],"female":[187],"addition,":[190],"affected":[193],"egg":[194],"production":[195],"release,":[197],"an":[198],"important":[199],"parameter":[201],"associated":[202],"immunopathogenesis":[204],"maintenance":[206],"life":[211],"cycle.":[212],"Overall,":[213],"integrated":[215],"findings":[216],"support":[217],"particularly":[223],"novel":[225],"as":[230],"preliminary":[231],"structural":[232],"hits":[233],"optimization":[236],"mechanistic":[238],"investigation.":[239]},"counts_by_year":[],"updated_date":"2026-11-04T10:54:05.112534","created_date":"2026-09-09T00:00:00"}