New thiazole-based thiazolidinone derivatives: Synthesis, in vitro α-amylase, α-glucosidase activities and silico molecular docking study

New thiazole-based thiazolidinone derivatives: Synthesis, in vitro α-amylase, α-glucosidase activities and silico molecular docking study

A series of thiazole-based thiazolidinone derivatives (1-20) have been synthesized and evaluated against α-glucosidase and α-amylase enzymes. All derivatives showed good α-glucosidase activity having IC50 values ranging from 2.40 ± 0.10 to 31.40 ± 0.90 μM and for α-amylase having IC50 values ranging...

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Published in:Chemical Data Collections
Main Author: Khan S.; Ullah H.; Rahim F.; Taha M.; Hussain R.; Khan M.S.; Ali H.; Khan M.U.; Shah S.A.A.; Khan K.M.
Format: Data paper
Language:English
Published: Elsevier B.V. 2022
Online Access:https://www.scopus.com/inward/record.uri?eid=2-s2.0-85142669443&doi=10.1016%2fj.cdc.2022.100967&partnerID=40&md5=3d2e0201d96f4b145daa5366ea80f3bc
id 2-s2.0-85142669443
spelling 2-s2.0-85142669443
Khan S.; Ullah H.; Rahim F.; Taha M.; Hussain R.; Khan M.S.; Ali H.; Khan M.U.; Shah S.A.A.; Khan K.M.
New thiazole-based thiazolidinone derivatives: Synthesis, in vitro α-amylase, α-glucosidase activities and silico molecular docking study
2022
Chemical Data Collections
42

10.1016/j.cdc.2022.100967
https://www.scopus.com/inward/record.uri?eid=2-s2.0-85142669443&doi=10.1016%2fj.cdc.2022.100967&partnerID=40&md5=3d2e0201d96f4b145daa5366ea80f3bc
A series of thiazole-based thiazolidinone derivatives (1-20) have been synthesized and evaluated against α-glucosidase and α-amylase enzymes. All derivatives showed good α-glucosidase activity having IC50 values ranging from 2.40 ± 0.10 to 31.40 ± 0.90 μM and for α-amylase having IC50 values ranging from 1.80 ± 0.05 to 27.60 ± 0.80 μM as compared to standard drug acarbose (IC50 = 9.80 ± 0.20 μM & 10.30 ±0.20 μM respectively). Analogues 5 (IC50 = 1.80 ± 0.05 & 2.40 ± 0.10 µM) and 10 (IC50 = 2.10 ± 0.10 & 3.60 ± 0.20 µM) showed potent inhibitory potential against both alpha-glucosidase and alpha-amylase enzymes. The structure-activity relationship has been established which mainly depends upon the number, nature, position, and electron donating/withdrawing effect of substituent/s on the aryl ring. A molecular docking study was also carried out to determine the binding interactions of the most potent analogues with the active site of the enzyme. © 2022 Elsevier B.V.
Elsevier B.V.
24058300
English
Data paper
author Khan S.; Ullah H.; Rahim F.; Taha M.; Hussain R.; Khan M.S.; Ali H.; Khan M.U.; Shah S.A.A.; Khan K.M.
spellingShingle Khan S.; Ullah H.; Rahim F.; Taha M.; Hussain R.; Khan M.S.; Ali H.; Khan M.U.; Shah S.A.A.; Khan K.M.
New thiazole-based thiazolidinone derivatives: Synthesis, in vitro α-amylase, α-glucosidase activities and silico molecular docking study
author_facet Khan S.; Ullah H.; Rahim F.; Taha M.; Hussain R.; Khan M.S.; Ali H.; Khan M.U.; Shah S.A.A.; Khan K.M.
author_sort Khan S.; Ullah H.; Rahim F.; Taha M.; Hussain R.; Khan M.S.; Ali H.; Khan M.U.; Shah S.A.A.; Khan K.M.
title New thiazole-based thiazolidinone derivatives: Synthesis, in vitro α-amylase, α-glucosidase activities and silico molecular docking study
title_short New thiazole-based thiazolidinone derivatives: Synthesis, in vitro α-amylase, α-glucosidase activities and silico molecular docking study
title_full New thiazole-based thiazolidinone derivatives: Synthesis, in vitro α-amylase, α-glucosidase activities and silico molecular docking study
title_fullStr New thiazole-based thiazolidinone derivatives: Synthesis, in vitro α-amylase, α-glucosidase activities and silico molecular docking study
title_full_unstemmed New thiazole-based thiazolidinone derivatives: Synthesis, in vitro α-amylase, α-glucosidase activities and silico molecular docking study
title_sort New thiazole-based thiazolidinone derivatives: Synthesis, in vitro α-amylase, α-glucosidase activities and silico molecular docking study
publishDate 2022
container_title Chemical Data Collections
container_volume 42
container_issue
doi_str_mv 10.1016/j.cdc.2022.100967
url https://www.scopus.com/inward/record.uri?eid=2-s2.0-85142669443&doi=10.1016%2fj.cdc.2022.100967&partnerID=40&md5=3d2e0201d96f4b145daa5366ea80f3bc
description A series of thiazole-based thiazolidinone derivatives (1-20) have been synthesized and evaluated against α-glucosidase and α-amylase enzymes. All derivatives showed good α-glucosidase activity having IC50 values ranging from 2.40 ± 0.10 to 31.40 ± 0.90 μM and for α-amylase having IC50 values ranging from 1.80 ± 0.05 to 27.60 ± 0.80 μM as compared to standard drug acarbose (IC50 = 9.80 ± 0.20 μM & 10.30 ±0.20 μM respectively). Analogues 5 (IC50 = 1.80 ± 0.05 & 2.40 ± 0.10 µM) and 10 (IC50 = 2.10 ± 0.10 & 3.60 ± 0.20 µM) showed potent inhibitory potential against both alpha-glucosidase and alpha-amylase enzymes. The structure-activity relationship has been established which mainly depends upon the number, nature, position, and electron donating/withdrawing effect of substituent/s on the aryl ring. A molecular docking study was also carried out to determine the binding interactions of the most potent analogues with the active site of the enzyme. © 2022 Elsevier B.V.
publisher Elsevier B.V.
issn 24058300
language English
format Data paper
accesstype
record_format scopus
collection Scopus
_version_ 1809678478994309120

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