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Assay Detail

CHEMBL3106983

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of human recombinant GST-tagged PFKFB3 expressed in Escherichia coli BL21(DE3) using fructose 6-phosphate as substrate preincubated for 30 mins before substrate addition measured after 60 mins by kinase-glo assay
23
Total Activities
23
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Publication

Targeting the Warburg Effect in cancer; relationships for 2-arylpyridazinones as inhibitors of the key glycolytic enzyme 6-phosphofructo-2-kinase/2,6-bisphosphatase 3 (PFKFB3).
Brooke DG, van Dam EM, Watts CK, Khoury A, Dziadek MA, Brooks H, Graham LJ, Flanagan JU, Denny WA.
Bioorg Med Chem (2014) 22 : 1029 -1039
PubMed 24398380 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 23 5.12 6.31

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3105838 1 6.31
CHEMBL3105833 1 5.58
CHEMBL3105830 1 5.47
CHEMBL3105828 1 5.16
CHEMBL3105839 1 5.13
CHEMBL3105826 1 5.08
CHEMBL3105832 1 5.06
CHEMBL3105827 1 5.04
CHEMBL3105829 1 5.02
CHEMBL3105834 1 4.96
CHEMBL3105845 1 4.89
CHEMBL3105844 1 4.58
CHEMBL3105825 1 4.26
CHEMBL3105835 1 -
CHEMBL3105836 1 -
CHEMBL1463854 1 -
CHEMBL3105840 1 -
CHEMBL3105841 1 -
CHEMBL3105842 1 -
CHEMBL3105843 1 -
CHEMBL3105846 1 -
CHEMBL3105847 1 -
CHEMBL3105831 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3105838 IC50 = 490.0 nM 6.31
CHEMBL3105833 IC50 = 2600.0 nM 5.58
CHEMBL3105830 IC50 = 3400.0 nM 5.47
CHEMBL3105828 IC50 = 7000.0 nM 5.16
CHEMBL3105839 IC50 = 7400.0 nM 5.13
CHEMBL3105826 IC50 = 8400.0 nM 5.08
CHEMBL3105832 IC50 = 8700.0 nM 5.06
CHEMBL3105827 IC50 = 9100.0 nM 5.04
CHEMBL3105829 IC50 = 9600.0 nM 5.02
CHEMBL3105834 IC50 = 11000.0 nM 4.96
CHEMBL3105845 IC50 = 13000.0 nM 4.89
CHEMBL3105844 IC50 = 26000.0 nM 4.58
CHEMBL3105825 IC50 = 55000.0 nM 4.26
CHEMBL3105835 IC50 > 500000.0 nM -
CHEMBL3105836 IC50 > 1000000.0 nM -
CHEMBL1463854 IC50 > 1000000.0 nM -
CHEMBL3105840 IC50 > 500000.0 nM -
CHEMBL3105841 IC50 > 1000000.0 nM -
CHEMBL3105842 IC50 > 1000000.0 nM -
CHEMBL3105843 IC50 > 1000000.0 nM -
CHEMBL3105846 IC50 > 500000.0 nM -
CHEMBL3105847 IC50 > 1000000.0 nM -
CHEMBL3105831 IC50 > 10000000.0 nM -