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Botanical Name Plant's Common Name Plant Family   

   MMP-AC0015 : Daidzein

 
Compound Name  :
Daidzein		  
  Compound Class  : Flavonoid  
  Synonyms  : daidzein; 486-66-8; 4',7-Dihydroxyisoflavone; Daidzeol; 7,4'-Dihydroxyisoflavone; 7-hydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one; Diadzein; 7-Hydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one; 4H-1-Benzopyran-4-one, 7-hydroxy-3-(4-hydroxyphenyl)- 7-hydroxy-3-(4-hydroxyphenyl)chromen-4-one; 7-Hydroxy-3-(4-hydroxyphenyl)-4-benzopyrone; UNII-6287WC5J2L; CCRIS 7600; K 251b; 4,7-Dihydroxyisoflavone; EINECS 207-635-4; BRN 0231523; CHEMBL8145; 4',7-Dihydroxy-iso-flavone; d-(+)-alpha-methylbenzylamine;

  
  Compound Extracted from  : Daidzein is extracted / reported from 5 Plant(s) of Melghat Flora as below


 
 
Molecular Formula  :
C15H10O4		  
  Molecular Weight  : 254.241  
  InChi Key  :  
  IUPAC  :  
  InChi  :  
  Hydrogen Bond Donor count  : 2  
  Hydrogen Bond Acceptor count  : 4  
  Rotational Bond count  : 1  
  TPSA  : 66.8  
  LogP Value  :

 2.5

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

 Yes

  
 
PubChem CID  :
5281708		  
  Drugbank ID  : DB13182  
  Super Natural  : -  
  CTD  : C004742  
  HIT  : C0282  
  NCI-60 GI50 data  :

 -

  
 
Reference(s)  :
https://www.ncbi.nlm.nih.gov/pubmed/29217487

  

Compound_ID Cell Lines Cancer Type IC50 Value EC50 Value ED50 Value GI50 Value References
MMP-AC0015 HL-60 Haematopoietic and Lymphoid tissue >10,000 ng/ml - - - 8084211
MMP-AC0015 Jurkat E6.1 Haematopoietic and Lymphoid tissue >75 µM - - - 15770547
MMP-AC0015 Molt-4 Haematopoietic and Lymphoid tissue >10,000 ng/ml - - - 8084211
MMP-AC0015 KB Nasopharyngeal >75 µM - - - 15770547
MMP-AC0015 DU-145 Prostate >50 µMol/L - - - 10460196
MMP-AC0015 LNCaP Prostate >50 µMol/L - - - 10460196
MMP-AC0015 PC-3 Prostate >50 µMol/L - - - 10460196
MMP-AC0015 HSC-45M2 Stomach - - 33 µg/mL (ID50) - 8242641
MMP-AC0015 SH101-P4 Stomach - - 36.5 µg/mL (ID50) - 8242641
MMP-AC0015 BFTC-905 Urinary Bladder 30?40 µg/ml - - - 10656454
MMP-AC0015 HT-1376 Urinary Bladder 0.5 µg/ml - - - 10656454
MMP-AC0015 J82 Urinary Bladder 40 µg/ml - - - 10656454
MMP-AC0015 RT4 Urinary Bladder 20 µg/ml - - - 10656454
MMP-AC0015 SCABER Urinary Bladder 40 µg/ml - - - 10656454
MMP-AC0015 T24 Urinary Bladder 40?50 µg/ml - - - 10656454
MMP-AC0015 TSGH8301 Urinary Bladder 40 µg/ml - - - 10656454

Compound_ID Target Gene_Name Gene_ID Cancer Cell_lines IC50 Value EC50 Value ED50 Value GI50 Value Remarks References
MMP-AC0015 BAX BCL2-associated X protein 581 Breast adenocarcinoma MCF-7 - - - - The serum metabolites of Puerariae radix inhibited cell proliferation via an up-regulation of p21/Waf1, p53, caspase-9, and Bax,as revealed by western blottin. 19013426
MMP-AC0015 CASP3 caspase 3, apoptosis-related cysteine peptidase 836 Breast Carcinoma Hs578T - - - It induced cell apoptosis through a caspase-3-dependent pathway and mediated cell cycle arrest in the G2/M phase. The induction of apoptosis in the breast cancer cell lines by genistein isoflavone confirmed by detection of increased caspase-3 activity in the isoflavone-treated HS578T and MDA-MB-231 cells. 19013426
MMP-AC0015 CASP3 caspase 3, apoptosis-related cysteine peptidase 836 Breast Carcinoma MDA-MB-231 - - - - It induced cell apoptosis through a caspase-3-dependent pathway and mediated cell cycle arrest in the G2/M phase. The induction of apoptosis in the breast cancer cell lines by genistein isoflavone confirmed by detection of increased caspase-3 activity in the isoflavone-treated HS578T and MDA-MB-231 cells. 19013426
MMP-AC0015 CASP9 caspase 9, apoptosis-related cysteine peptidase 842 Breast adenocarcinoma MCF-7 - - - - The serum metabolites of Puerariae radix inhibited cell proliferation via an up-regulation of p21/Waf1, p53, caspase-9, and Bax,as revealed by western blottin. 19013426
MMP-AC0015 CDK2 cyclin-dependent kinase 2 1017 Human Melanoma OCM-1 - - - - Daidzein, which induced a cell cycle block in G1, inhibited the activity of CDK-2 by 40-60%. 11322924
MMP-AC0015 CDKN1A cyclin-dependent kinase inhibitor 1A (p21, Cip1) 1026 Human Melanoma OCM-1 - - - - Daidzein, which inhibited CDK2 and induced a G1 block, up-regulated p21CIP1. 11322924
MMP-AC0015 CDKN1A cyclin-dependent kinase inhibitor 1A (p21, Cip1) 1026 Breast adenocarcinoma MCF-7 - - - The serum metabolites of Puerariae radix inhibited cell proliferation via an up-regulation of p21/Waf1, p53, caspase-9, and Bax,as revealed by western blottin. 19013426
MMP-AC0015 CDKN1B cyclin-dependent kinase inhibitor 1B (p27, Kip1) 1027 Human Melanoma OCM-1 - - - - Daidzein, which inhibited CDK2 and induced a G1 block, up-regulated p21CIP1 and, to a lower extent, p27KIP. 11322924
MMP-AC0015 TP53 tumor protein p53 7157 Breast adenocarcinoma MCF-7 - - - The serum metabolites of Puerariae radix inhibited cell proliferation via an up-regulation of p21/Waf1, p53, caspase-9, and Bax,as revealed by western blottin. 19013426