In Silico Screening and Synthesis of 4-Thiazo...

In Silico Screening and Synthesis of 4-Thiazolidinone Containing 1, 3-Thiazole Analogs

Author Name : Anagh Mukherjee, Aayusree Ray

DOI: https://doi.org/10.56025/IJARESM.2023.118231599

ABSTRACTS The present work based on the In-silico screening and synthesis of some 4-thiazolidinone containing 1, 3 thiazole analogs as Janus Kinase-1 inhibition activity. All the proposed 4-thiazolidinone containing 1, 3 thiazole compounds were evaluated for in-silico JAK-1 inhibition activity using PDB (6sm8) and baricitinib as standard, in Swiss dock web tool. All the compounds showing prominent activity in docking study compare to reference standard (Baricitinib). Pharmacophore modeling also depicted that all the compounds should have at least 3 aromatic groups and 4 acceptors for showing good activity. Synthesis of 2-(4-chloro-phenyl-3-(4-phenyl-1, 3-thiazol-2-yl)-1, 3- thiazolidin-4-one by conventional method supported the proposed structures to validate.