Structure-based design of HSPA5 inhibitors: From peptide to small molecule inhibitors
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15/05/2013
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| Resumo |
<p>We identified nine small-molecule hit compounds of Heat shock 70 kDa protein 5 (HSPA5) from cascade in silico screening based on the binding modes of the tetrapeptides derived from the peptide substrate or inhibitors of Escherichia coli HSP70. Two compounds exhibit promising inhibition activities from cancer cell viability and tumor inhibition assays. The binding modes of the hit compounds provide a platform for development of selective small molecule inhibitors of HSPA5. (C) 2013 Elsevier Ltd. All rights reserved.</p> |
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| Idioma(s) |
eng |
| Direitos |
info:eu-repo/semantics/restrictedAccess |
| Fonte |
Huang , M , Li , Z , Li , D , Walker , S , Greenan , C & Kennedy , R 2013 , ' Structure-based design of HSPA5 inhibitors: From peptide to small molecule inhibitors ' Bioorganic & Medicinal Chemistry Letters , vol 23 , no. 10 , pp. 3044-3050 . DOI: 10.1016/j.bmcl.2013.03.035 |
| Palavras-Chave | #Peptide substrate #Apoptosis #HEAT-SHOCK-PROTEIN #HSP70 #HSP90 #CHAPERONE DNAK #Cancer #In silico screening #INDUCED APOPTOSIS #SUBSTRATE-BINDING #IDENTIFICATION #HSP70 inhibitors #HEAT-SHOCK-PROTEIN-70 #SPECIFICITY #MODULATORS |
| Tipo |
article |
