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Their physical properties were documented, and cytotoxicity was evaluated against normal lymphocytes, leukemic, adherent, and nontumor cell lines. Compounds\n                    <jats:bold>11<\/jats:bold>\n                    ,\n                    <jats:bold>15<\/jats:bold>\n                    , and\n                    <jats:bold>16<\/jats:bold>\n                    were inactive, while compound\n                    <jats:bold>17<\/jats:bold>\n                    affected both normal and cancer cells. Compounds\n                    <jats:bold>18<\/jats:bold>\n                    and\n                    <jats:bold>20<\/jats:bold>\n                    showed activity against BJ and A549 cell lines, with compound\n                    <jats:bold>20<\/jats:bold>\n                    being selective for T\u2010cell leukemias and compound\n                    <jats:bold>18<\/jats:bold>\n                    moderately affecting B\u2010cell leukemia. Compound\n                    <jats:bold>12<\/jats:bold>\n                    specifically affected the HCTp53 KO cell line, while compounds\n                    <jats:bold>13<\/jats:bold>\n                    and\n                    <jats:bold>14<\/jats:bold>\n                    were selective for U2O2 and HCT116 cell lines, respectively. Compound\n                    <jats:bold>14<\/jats:bold>\n                    was highly specific for T\u2010cell leukemia, whereas compound\n                    <jats:bold>19<\/jats:bold>\n                    was specific for A549 and moderately specific for B\u2010cell lines. Compound\n                    <jats:bold>22<\/jats:bold>\n                    affected all tumor cell lines except A549. The active compound induces apoptosis since it activates caspase 3. Spheroid testing revealed that compounds\n                    <jats:bold>13<\/jats:bold>\n                    and\n                    <jats:bold>22<\/jats:bold>\n                    specifically affected HCT116 spheroids, while compound\n                    <jats:bold>19<\/jats:bold>\n                    affected A549 spheroids. Both in vitro and computational analyses demonstrated that compounds\n                    <jats:bold>11<\/jats:bold>\n                    ,\n                    <jats:bold>12<\/jats:bold>\n                    , and\n                    <jats:bold>13<\/jats:bold>\n                    exhibit high affinity for the A C\u03b1 subunit of protein kinase A. This suggests a kinase\u2010targeted mechanism of action, providing a structural foundation for future design strategies to optimize the potency of these lead compounds.\n                  <\/jats:p>","DOI":"10.1002\/cmdc.70425","type":"journal-article","created":{"date-parts":[[2026,8,5]],"date-time":"2026-08-05T03:24:16Z","timestamp":1785900256000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":1,"title":["New 1,2,3\u2010Triazole Hybrids as Anticancer Agents: Design, Synthesis, Characterization, and In Silico Studies"],"prefix":"10.1002","volume":"21","author":[{"given":"Alirica I.","family":"Su\u00e1rez","sequence":"first","affiliation":[{"name":"Laboratorio de Productos Naturales Facultad de Farmacia Universidad Central de Venezuela  Caracas Venezuela"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Katiuska E.","family":"Ch\u00e1vez","sequence":"additional","affiliation":[{"name":"Laboratorio de Productos Naturales Facultad de Farmacia Universidad Central de Venezuela  Caracas Venezuela"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Pablo","family":"Mart\u00ednez","sequence":"additional","affiliation":[{"name":"Direcci\u00f3n de Salud Fundaci\u00f3n Estudios Avanzados IDEA  Caracas Venezuela"},{"name":"Departamento de Biolog\u00eda Universidad Sim\u00f3n Bol\u00edvar  Caracas Venezuela"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Jos\u00e9","family":"Bubis","sequence":"additional","affiliation":[{"name":"Direcci\u00f3n de Salud Fundaci\u00f3n Estudios Avanzados IDEA  Caracas Venezuela"},{"name":"Departamento de Biolog\u00eda Universidad Sim\u00f3n Bol\u00edvar  Caracas Venezuela"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Zuleyma","family":"Blanco","sequence":"additional","affiliation":[{"name":"Laboratorio de S\u00edntesis Org\u00e1nica Facultad de Farmacia Universidad Central de Venezuela  Caracas Venezuela"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-1916-6118","authenticated-orcid":false,"given":"Hegira","family":"Ram\u00edrez","sequence":"additional","affiliation":[{"name":"Universidad ECOTEC  Guayaquil Guayas Ecuador"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-4977-1899","authenticated-orcid":false,"given":"Jenny Valentina","family":"Garmendia","sequence":"additional","affiliation":[{"name":"Institute of Molecular and Translational Medicine Faculty of Medicine and Dentistry Palacky University  Olomouc Czech Republic"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-5480-4608","authenticated-orcid":false,"given":"Juan Bautista","family":"De Sanctis","sequence":"additional","affiliation":[{"name":"Institute of Molecular and Translational Medicine Faculty of Medicine and Dentistry Palacky University  Olomouc Czech Republic"},{"name":"Czech Advanced Technologies and Research Institute (CATRIN) Institute of Molecular and Translational Medicine. Palacky University  Olomouc Czech Republic"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"So\u0148a","family":"Gursk\u00e1","sequence":"additional","affiliation":[{"name":"Institute of Molecular and Translational Medicine Faculty of Medicine and Dentistry Palacky University  Olomouc Czech Republic"},{"name":"Czech Advanced Technologies and Research Institute (CATRIN) Institute of Molecular and Translational Medicine. Palacky University  Olomouc Czech Republic"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Petr","family":"D\u017eub\u00e1k","sequence":"additional","affiliation":[{"name":"Institute of Molecular and Translational Medicine Faculty of Medicine and Dentistry Palacky University  Olomouc Czech Republic"},{"name":"Czech Advanced Technologies and Research Institute (CATRIN) Institute of Molecular and Translational Medicine. Palacky University  Olomouc Czech Republic"},{"name":"Laboratory of Experimental Medicine. University Hospital Olomouc.  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