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- Title
Computer Analysis of the Structure-Activity Relationship for Immunoactive Thiazolo[3,2-a]Benzimidazole Derivatives.
- Authors
Dianov, V. M.; Alekhin, E. K.; Tyurina, L. A.; Aleksandrova, E. L.
- Abstract
Computer analysis of the structure-activity relationship and purposeful design of effective immunomodulators among thiazolo[3,2-a]benzimidazole derivatives was performed. A mathematical recognition model was formulated. Immunomodulating activity of condensed azoles was predicted (80 - 100% learning recognition). Potentially active structures were generated. Their activities were predicted. Theoretical and experimental results agreed. The tested thiazolo[3,2-a]benzimidazole derivatives exhibited the predicted activities.
- Subjects
STRUCTURE-activity relationship in pharmacology; THIAZOLES; BENZIMIDAZOLE derivatives; IMMUNOMODULATORS; MOLECULAR recognition
- Publication
Pharmaceutical Chemistry Journal, 2018, Vol 52, Issue 4, p316
- ISSN
0091-150X
- Publication type
Article
- DOI
10.1007/s11094-018-1814-5