scholarly journals In Silico Analysis and Experimental Validation of Active Compounds from Cichorium intybus L. Ameliorating Liver Injury

2015 ◽  
Vol 16 (9) ◽  
pp. 22190-22204 ◽  
Author(s):  
Guo-Yu Li ◽  
Ya-Xin Zheng ◽  
Fu-Zhou Sun ◽  
Jian Huang ◽  
Meng-Meng Lou ◽  
...  
Keyword(s):  
Liver Injury ◽  
In Silico ◽  
Experimental Validation ◽  
In Silico Analysis ◽  
Cichorium Intybus ◽  
Active Compounds ◽  
Silico Analysis

scholarly journals In silico Analysis and Experimental Validation of Lignan Extracts from Kadsura longipedunculata for Potential 5-HT1AR Agonists

PLoS ONE ◽  
2015 ◽  
Vol 10 (6) ◽  
pp. e0130055 ◽  
Author(s):  
Yaxin Zheng ◽  
Jiming Wu ◽  
Xuesong Feng ◽  
Ying Jia ◽  
Jian Huang ◽  
...  
Keyword(s):  
In Silico ◽  
Experimental Validation ◽  
In Silico Analysis ◽  
Silico Analysis

scholarly journals Proapoptosis Effect of Root of Eurycoma longifolia (Pasak Bumi) on the Prostate Cancer: In Silico Analysis

2020 ◽  
Vol 20 ◽  
pp. 03003
Author(s):  
Eka Yudha Rahman ◽  
Mulyohadi Ali ◽  
Basuki Bambang Purnomo ◽  
Nia Kania
Keyword(s):  
Prostate Cancer ◽  
In Silico ◽  
Caspase 3 ◽  
In Silico Analysis ◽  
Data Bank ◽  
Active Ingredients ◽  
Caspase 9 ◽  
Active Compounds ◽  
Eurycoma Longifolia ◽  
Silico Analysis

This study aimed to predict the proapoptosis effect of E. longifolia active compounds on prostate cancer by in silico analysis. Protein data such as BCL-2 (GI: 2506216), Caspase 3 (GI: 6978605), Caspase 8(GI: 11560103), data quassinoid (ID: 5459060 and chantin (ID: 97176) were collected from GenBank of NCBI. Protein BCL-2 collected from NCBI compare with Protein Data Bank (PDB) and UNIPROT. The docking process was carried out using software HEX 8.0. to compute the binding affinity between ligands (active compounds of Pasak Bumi) and protein target. The interaction between quassinoid and chantin was strongest and stable against caspase-9, indicating that the active ingredient in E. longifolia triggered caspase-9 activity after activation of BH3 domains in Bcl-2 in prostate cancer. The low energy binding between quassinoid and chantin with caspase-3 indicates the interaction between the active ingredients is not strong with caspase-3. E. longifolia active ingredients that are potentially used in the treatment of prostate cancer are quassinoid and chantin by inducing apoptotic mechanisms via both extrinsic and intrinsic pathways. The combination of active ingredients of E. longifolia that is quassinoid and chantin can be used as a strategy of prostate cancer therapy both through extrinsic and intrinsic pathways.

scholarly journals In silico analysis of active compounds from ethanol extract of Curcuma xanthorrhiza on COX-2 receptors as anti-inflammation candidate

2021 ◽  
Author(s):  
Herawati Herawati ◽  
Yudit Oktanella ◽  
Agri Kaltaria Anisa ◽  
Dyah Kinasih Wuragil ◽  
Aulanni'am Aulanni'am
Keyword(s):  
In Silico ◽  
In Silico Analysis ◽  
Ethanol Extract ◽  
Active Compounds ◽  
Curcuma Xanthorrhiza ◽  
Cox 2 ◽  
Silico Analysis ◽  
Anti Inflammation

scholarly journals In silico analysis of HLA associations with drug-induced liver injury: use of a HLA-genotyped DNA archive from healthy volunteers

10.1186/gm350 ◽  
2012 ◽  
Vol 4 (6) ◽  
pp. 51 ◽  
Author(s):  
Ana Alfirevic ◽  
Faviel Gonzalez-Galarza ◽  
Catherine Bell ◽  
Klara Martinsson ◽  
Vivien Platt ◽  
...  
Keyword(s):  
Liver Injury ◽  
Healthy Volunteers ◽  
In Silico ◽  
In Silico Analysis ◽  
Drug Induced ◽  
Drug Induced Liver Injury ◽  
Silico Analysis
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