[vc_empty_space][vc_empty_space]
Absorption, distribution and toxicity prediction of andrographolide and its derivatives as anti-HIV drugs
Megantara S.a,b, Levita J.b, Iwo M.I.a, Ibrahim S.a
a Bandung Institute of Technology, School of Pharmacy, Bandung, Indonesia
b Faculty of Pharmacy, Universitas Padjadjaran, Indonesia
[vc_row][vc_column][vc_row_inner][vc_column_inner][vc_separator css=”.vc_custom_1624529070653{padding-top: 30px !important;padding-bottom: 30px !important;}”][/vc_column_inner][/vc_row_inner][vc_row_inner layout=”boxed”][vc_column_inner width=”3/4″ css=”.vc_custom_1624695412187{border-right-width: 1px !important;border-right-color: #dddddd !important;border-right-style: solid !important;border-radius: 1px !important;}”][vc_empty_space][megatron_heading title=”Abstract” size=”size-sm” text_align=”text-left”][vc_column_text]© 2018 International Congress of Chemistry and Environment. All rights reserved.Andrographolide is a major bioactive labdane diterpenoidal compound of the medicinal plant Andrographis paniculata. Previous study concluded that Andrographis paniculata herb extract has been proven to exert anti-HIV activity and has also been proven with in silico methods that andrographolide can act as inhibitors with HIV-1 protease, a retroviral aspartyl protease (retro pepsin) that is essential for the life-cycle of HIV, the retrovirus that causes AIDS. The present study was intended to obtain detail information of the pharmacokinetic properties including absorption, distribution and toxicity of andrographolide and its derivatives using in silico methods. Pharmacokinetic properties, absorption as well as distribution prediction using parameters of HIA (Human Intestinal Absorption), permeability to Caco-2 cells and plasma protein binding (PPB) were studied using PreADMET. Toxicity was predicted by Toxtree package. The result showed that andrographolide and its derivatives well absorbed in intestinal were strongly bound to plasma protein having medium permeability to Caco-2 cells. Based on computational scores, three andrographolide derivatives showed better absorption and distribution properties than andrographolide. Toxicity prediction of andrographolide and its derivatives showed no mutagenic or carcinogenic properties.[/vc_column_text][vc_empty_space][vc_separator css=”.vc_custom_1624528584150{padding-top: 25px !important;padding-bottom: 25px !important;}”][vc_empty_space][megatron_heading title=”Author keywords” size=”size-sm” text_align=”text-left”][vc_column_text][/vc_column_text][vc_empty_space][vc_separator css=”.vc_custom_1624528584150{padding-top: 25px !important;padding-bottom: 25px !important;}”][vc_empty_space][megatron_heading title=”Indexed keywords” size=”size-sm” text_align=”text-left”][vc_column_text]AIDS,Andrographolide,Andrographolide derivatives,HIV-1 protease,In silico[/vc_column_text][vc_empty_space][vc_separator css=”.vc_custom_1624528584150{padding-top: 25px !important;padding-bottom: 25px !important;}”][vc_empty_space][megatron_heading title=”Funding details” size=”size-sm” text_align=”text-left”][vc_column_text]This research was financially supported by Research and Innovation Scientific Group Grant of the Bandung Institute of Technology 2016.[/vc_column_text][vc_empty_space][vc_separator css=”.vc_custom_1624528584150{padding-top: 25px !important;padding-bottom: 25px !important;}”][vc_empty_space][megatron_heading title=”DOI” size=”size-sm” text_align=”text-left”][vc_column_text][/vc_column_text][/vc_column_inner][vc_column_inner width=”1/4″][vc_column_text]Widget Plumx[/vc_column_text][/vc_column_inner][/vc_row_inner][/vc_column][/vc_row][vc_row][vc_column][vc_separator css=”.vc_custom_1624528584150{padding-top: 25px !important;padding-bottom: 25px !important;}”][/vc_column][/vc_row]