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Botanical Name Plant's Common Name Plant Family   

   MMP-AC0070 : Deguelin

 
Compound Name  :
Deguelin		  
  Compound Class  : Flavonoid  
  Synonyms  : Deguelin; 522-17-8; (-)-cis-deguelin; (-)-Deguelin; DEGUELIN(-);

  
  Compound Extracted from  : Deguelin is extracted / reported from 1 Plant(s) of Melghat Flora as below


 
 
Molecular Formula  :
C23H22O6		  
  Molecular Weight  : 394.4  
  InChi Key  :  
  IUPAC  :  
  InChi  :  
  Hydrogen Bond Donor count  : 0  
  Hydrogen Bond Acceptor count  : 6  
  Rotational Bond count  : 2  
  TPSA  : 63.2  
  LogP Value  :

 3.7

  
 
Lipinski Rule of Five  :
Yes		  
  Ghose Filter  : Yes  
  Veber Filter  : Yes  
  Muegge Filter  :

 Yes

  
 
PubChem CID  :
107935		  
  Drugbank ID  : -  
  Super Natural  : -  
  CTD  : C107676  
  HIT  : -  
  NCI-60 GI50 data  :

 -

  
 
Reference(s)  :
https://www.ncbi.nlm.nih.gov/pubmed/26592500

  

Compound_ID Cell Lines Cancer Type IC50 Value EC50 Value ED50 Value GI50 Value References
MMP-AC0070 U-937 Haematopoietic and Lymphoid tissue 21.61 nMol/L (24hr) - - - 16174445
MMP-AC0070 U-937 Haematopoietic and Lymphoid tissue 17.07 nMol/L (36hr) - - - 16174445

Compound_ID Target Gene_Name Gene_ID Cancer Cell_lines IC50 Value EC50 Value ED50 Value GI50 Value Remarks References
MMP-AC0070 AKT1 v-akt murine thymoma viral oncogene homolog 1 207 Human promyelocytic leukemia HL-60 - - - - P-Akt protein level in HL-60 cells was reduced after 24-48 h treatment with deguelin at the concentrations of 20.14 nM. This indicates that deguelin promotes P-Akt protein degradation in HL-60 cells in a time-dependent manner. 19455392
MMP-AC0070 BCL2 B-cell CLL/lymphoma 2 596 Human promyelocytic leukemia HL-60 - - - - After treated with 20.14 µM deguelin for 24, 48 h, the expression of Bcl-2 was down-regulated dramatically in a time-dependent manner. 19455392
MMP-AC0070 birc5a baculoviral IAP repeat-containing 5a 373110 Adult T-cell leukemia (ATL) KUT-1 - - - - Deguelin treatment for 24 h reduced the protein level of survivin. These results suggest that cell death of KUT-1 cells by deguelin is induced in part via the down-regulation of survivin expression. 19781773
MMP-AC0070 CASP3 caspase 3, apoptosis-related cysteine peptidase 836 Adult T-cell leukemia (ATL) KUT-1 - - - - Caspase-3 was cleaved after treatment of KUT-1 cells with deguelin for at least 24 h, suggesting that deguelin induces cell death of these cells, at least in part via the apoptosis pathway involving caspase-3. 19781773
MMP-AC0070 HSPA4 heat shock 70kDa protein 4 3308 Adult T-cell leukemia (ATL) KUT-1 - - - - Deguelin upregulated Hsp70 expression as well as 17-DMAG(Hsp90 inhibitor). These results suggested that deguelin acts as Hsp90 inhibitor in KUT-1 cells. 19781773
MMP-AC0070 PARP1 poly (ADP-ribose) polymerase 1 142 Adult T-cell leukemia (ATL) KUT-1 - - - - PARP was cleaved after treatment of KUT-1 cells with deguelin for at least 24 h, suggesting that deguelin induces cell death of these cells. 19781773
MMP-AC0070 STAT3 signal transducer and activator of transcription 3 (acute-phase response factor) 6774 Adult T-cell leukemia (ATL) KUT-1 - - - - STAT3 phosphorylationwas suppressed at 6-9 h, after treatment of KUT-1 andMT-2 cellswith deguelin. On the other hand, Erk1/2 phosphorylation was not inhibited by deguelin treatment in these cells , indicating the selectivity of deguelin for STAT proteins in KUT-1 and MT-2 cells. 19781773
MMP-AC0070 STAT5B signal transducer and activator of transcription 5B 6777 Adult T-cell leukemia (ATL) KUT-1 - - - - STAT5 phosphorylation was suppressed in KUT-1 but not MT-2 cells. On the other hand, Erk1/2 phosphorylation was not inhibited by deguelin treatment in these cells , indicating the selectivity of deguelin for STAT proteins in KUT-1 and MT-2 cells. 19781773