Lead optimization generates selenium-containing miconazole CYP51 inhibitors with improved pharmacological profile for the treatment of fungal infections

2021 ◽  
Vol 216 ◽  
pp. 113337
Author(s):  
Hang Xu ◽  
Zhong-zuo Yan ◽  
Meng-bi Guo ◽  
Ran An ◽  
Xin Wang ◽  
...  
2017 ◽  
Vol 60 (12) ◽  
pp. 5086-5098 ◽  
Author(s):  
Juliette Emmerich ◽  
Chris J. van Koppen ◽  
Jens L. Burkhart ◽  
Qingzhong Hu ◽  
Lorenz Siebenbürger ◽  
...  

1993 ◽  
Vol 26 (6) ◽  
pp. 1007-1035 ◽  
Author(s):  
Andrew Blitzer ◽  
William Lawson

2006 ◽  
Vol 39 (8) ◽  
pp. 66
Author(s):  
NANCY WALSH
Keyword(s):  

2012 ◽  
Vol 5 (8) ◽  
pp. 12
Author(s):  
PATRICE WENDLING

Author(s):  
Shashank Shekhar Mishra ◽  
Chandra Shekhar Sharma ◽  
Hemendra Pratap Singh ◽  
Harshda Pandiya ◽  
Neeraj Kumar

Tuberculosis, one of the most frequent infectious diseases, is caused by a mycobacterium tuberculosis bacteria and it infects several hundred million people each year, results in several million deaths annually. Because there is development of antibiotic resistance, the disease becomes incurable. So, in the absence of effective and potent drug with minimal resistance problems, the mortality rate increases annually. In this computational investigation, we performed In-silico ADME, bioactivity and toxicity parameters calculation of some selected anti-tuberculosis agents. To design a new molecule having good pharmacological profile, this study will provide the lead information.Key Words: Tuberculosis (TB), Bacillus Calmette-Guerin vaccine, TPSA, In Silico toxicity


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