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Title: | In vitro and in silico biological studies of novel thiazolo[3,2-a]pyrimidine-6-carboxylate derivatives |
Authors: | Umesha K, Sarojini BK, Darshan Raj CG, Bhanuprakash V, Yogisharadhya R, Raghavendra R, Mahmud T, Khan H |
ICAR Data Use Licennce: | http://krishi.icar.gov.in/PDF/ICAR_Data_Use_Licence.pdf |
Author's Affiliated institute: | ICAR-Indian Veterinary Research Institute |
Published/ Complete Date: | 2013-05-23 |
Keywords: | Thiazolo[3,2-a]pyrimidine-6-carboxylate, In vitro antimicrobial activity, In vitro antiviral activity,In silico docking studies |
Publisher: | Springer |
Abstract/Description: | In the present study, we report the synthesis,characterization of new series of thiazolo[3,2-a]pyrimi-dine-6-carboxylate derivatives 3a–f and 4a–f. The newlysynthesized compounds were screened for in vitro antimi-crobial and antiviral activities. The probable mode ofaction of these active compounds was determined throughin silico docking study by docking the receptor methionyl-tRNA synthetase and human inosine-50-monophosphatedehydrogenase (IMPDH) for antibacterial and antiviralactivities, respectively. Among the compounds, 4c exhib-ited excellent in vitro antimicrobial activity against alltested strains with binding and docking energies -35.6 and-12.4 kcal/mol, respectively. The antiviral studies werecarried out for the selected compounds in which 4aexhibited 73.69 and 54.42 % of inhibition of buffalopoxand camelpox viruses, respectively. Furthermore, com-pound 4a showed minimum docking and binding energyalong with the maximum hydrogen/hydrophobic interac-tion with IMPDH. The study contributes towards identifi-cation and screening of potential antimicrobial andantiviral agent’s against the pathogens |
Type(s) of content: | Research Paper |
Language: | English |
Name of Journal: | MEDICINALCHEMISTRY RESEARCH |
Journal Type: | Included in NAAS Journal List |
NAAS Rating: | 8.35 |
Impact Factor: | 2.351 |
Volume No.: | 23[1] |
Page Number: | 1-13 |
Name of the Division/Regional Station: | ICAR-IVRI, HA Farm, Hebbal, Bengaluru 560024, Karnataka |
Source, DOI or any other URL: | 10.1007/s00044-013-0606-4 |
URI: | http://krishi.icar.gov.in/jspui/handle/123456789/77493 |
Appears in Collections: | AS-IVRI-Publication |
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