Structure–activity relationship of a series of 1,2-dihydroquinoline analogues and binding mode with Vibrio cholerae dihydrofolate reductase

2016 ◽  
Vol 25 (8) ◽  
pp. 1524-1537 ◽  
Author(s):  
Vítor W. Rabelo ◽  
Thienne F. Sampaio ◽  
Lívia D. Duarte ◽  
Desirée H. B. Lopes ◽  
Paula A. Abreu
Keyword(s):  
Vibrio Cholerae ◽  
Dihydrofolate Reductase ◽  
Binding Mode ◽  
Structure Activity Relationship ◽  
Activity Relationship ◽  
Structure Activity ◽  
Relationship Of

scholarly journals Structural Optimization and Structure–Activity Relationship of 4-Thiazolidinone Derivatives as Novel Inhibitors of Human Dihydroorotate Dehydrogenase

Molecules ◽  
2019 ◽  
Vol 24 (15) ◽  
pp. 2780
Author(s):  
Fanxun Zeng ◽  
Lina Quan ◽  
Guantian Yang ◽  
Tiantian Qi ◽  
Letian Zhang ◽  
...  
Keyword(s):  
Binding Mode ◽  
Structure Activity Relationship ◽  
Immunosuppressive Drugs ◽  
Activity Relationship ◽  
Dihydroorotate Dehydrogenase ◽  
Structure Activity ◽  
Docking Method ◽  
Ic50 Values ◽  
Relationship Of ◽  
Molecular Docking Method

Human dihydroorotate dehydrogenase (hDHODH), one of the attractive targets for the development of immunosuppressive drugs, is also a potential target of anticancer drugs and anti-leukemic drugs. The development of promising hDHODH inhibitors is in high demand. Based on the unique binding mode of our previous reported 4-thiazolidinone derivatives, via molecular docking method, three new series 4-thiazolidinone derivatives were designed and synthesized as hDHODH inhibitors. The preliminary structure–activity relationship was investigated. Compound 9 of biphenyl series and compound 37 of amide series displayed IC50 values of 1.32 μM and 1.45 μM, respectively. This research will provide valuable reference for the research of new structures of hDHODH inhibitors.

Structure-activity relationship of (-) mammea A/BB derivatives against Leishmania amazonensis

Planta Medica ◽  
2008 ◽  
Vol 74 (09) ◽  
Author(s):  
MA Brenzan ◽  
CV Nakamura ◽  
BPD Filho ◽  
T Ueda-Nakamura ◽  
MCM Young ◽  
...  
Keyword(s):  
Structure Activity Relationship ◽  
Leishmania Amazonensis ◽  
Activity Relationship ◽  
Structure Activity ◽  
Relationship Of
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