title: Synthesis, biological evaluation and molecular modeling studies of some novel thiazolidinediones with triazole ring.
abstract: A new series of thiazolidinedione derivatives were synthesized and evaluated for in vitro α-glucosidase inhibition and anticancer activities. Compounds 3d, 3e and 3j showed potential α-glucosidase inhibition with IC₅₀ values ranging between 0.1 and 0.3 μg/ml whereas compounds 3i, 3j and 3k have showed better anticancer activity towards human cancer cell lines IMR-32 (neuroblastoma), Hep-G2 (hepatoma) and MCF-7 (breast). Molecular docking studies revealed compounds 3d, 3e and 3j are potent inhibitors of α-glucosidase and also showed compliance with standard parameters of drug likeness.
authors.affiliation: Natural Product Chemistry, CSIR-Central Institute of Medicinal and Aromatic Plants-Research Centre, Boduppal, Hyderabad 500092, A.P., India.
authors.forename: Yakaiah
authors.initials: Y
authors.lastname: Chinthala
authors.forename: Anand
authors.initials: A
authors.lastname: Kumar Domatti
authors.forename: Alam
authors.initials: A
authors.lastname: Sarfaraz
authors.forename: Shailendra Pratap
authors.initials: SP
authors.lastname: Singh
authors.forename: Niranjan
authors.initials: N
authors.lastname: Kumar Arigari
authors.forename: Namita
authors.initials: N
authors.lastname: Gupta
authors.forename: Srinivas K V N
authors.initials: SK
authors.lastname: Satya
authors.forename: Jonnala
authors.initials: J
authors.lastname: Kotesh Kumar
authors.forename: Feroz
authors.initials: F
authors.lastname: Khan
authors.forename: Ashok K
authors.initials: AK
authors.lastname: Tiwari
authors.forename: Grover
authors.initials: G
authors.lastname: Paramjit
mesh_terms: D000970:Antineoplastic Agents / Q000138:chemical synthesis / Q000737:chemistry / Q000494:pharmacology*; D045744:Cell Line, Tumor; D049109:Cell Proliferation / Q000187:drug effects; D004305:Dose-Response Relationship, Drug; D004354:Drug Screening Assays, Antitumor; D004791:Enzyme Inhibitors / Q000138:chemical synthesis / Q000737:chemistry / Q000494:pharmacology*; D065089:Glycoside Hydrolase Inhibitors; D056945:Hep G2 Cells; D006801:Humans; D061986:MCF-7 Cells; D008958:Models, Molecular; D015394:Molecular Structure; D013329:Structure-Activity Relationship; D045162:Thiazolidinediones / Q000138:chemical synthesis / Q000737:chemistry / Q000494:pharmacology*; D014230:Triazoles / Q000737:chemistry*; D000520:alpha-Glucosidases / Q000378:metabolism
chemical_list: D000970:Antineoplastic Agents; D004791:Enzyme Inhibitors; D065089:Glycoside Hydrolase Inhibitors; D045162:Thiazolidinediones; D014230:Triazoles; D000520:alpha-Glucosidases
keywords: 1,2,3-Triazoles; Anticancer activity; Molecular modeling study; Thiazolidinediones; α-Glucosidase inhibition