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Assay Detail

CHEMBL5325968

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

Binding
Inhibition of C-terminal 6xHis-tagged human DNA polymerase eta (1 to 511 residues) expressed in Escherichia coli BL21 DE3 using 5'-IRD700-GCAGGTCGACTCCAAAG-3' primer/ 5'-TCGGTACCGGGTTAGCCTTTGGAGTCGACCTGC-3' template as DNA substrate incubated for 60 mins in presence of Mg2+ by bromophenol blue staining based assay
35
Total Activities
35
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

Target

DNA polymerase eta (CHEMBL5542)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Computer-aided identification, synthesis, and biological evaluation of DNA polymerase η inhibitors for the treatment of cancer.
Munafò F, Nigro M, Brindani N, Manigrasso J, Geronimo I, Ottonello G, Armirotti A, De Vivo M.
Eur J Med Chem (2023) 248 : 115044 -115044
PubMed 36621139 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 35 4.65 5.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL457821 1 5.30
CHEMBL5398631 1 5.11
CHEMBL243677 1 5.06
CHEMBL1277701 1 4.99
CHEMBL163316 3-O-METHYLQUERCETIN 1 4.97
CHEMBL8260 BAICALEIN 2.0 1 4.93
CHEMBL151 LUTEOLIN 2.0 1 4.90
CHEMBL150 KAEMPFEROL 1.0 1 4.90
CHEMBL5418159 1 4.86
CHEMBL117 CHRYSIN 1 4.83
CHEMBL5272459 1 4.83
CHEMBL50 QUERCETIN 3.0 1 4.80
CHEMBL165064 ISOKAEMPFERIDE 1 4.79
CHEMBL28 APIGENIN 1 4.65
CHEMBL5279962 1 4.58
CHEMBL301624 1 4.57
CHEMBL222556 1 4.52
CHEMBL3326852 1 4.47
CHEMBL3326854 1 4.21
CHEMBL5280903 1 4.07
CHEMBL5284680 1 4.06
CHEMBL5271510 1 4.06
CHEMBL44 GENISTEIN 2.0 1 4.03
CHEMBL5440374 1 4.01
CHEMBL594248 1 -
CHEMBL5403947 1 -
CHEMBL5411625 1 -
CHEMBL5419567 1 -
CHEMBL5435484 1 -
CHEMBL5409887 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL457821 IC50 = 5000.0 nM 5.30
CHEMBL5398631 IC50 = 7700.0 nM 5.11
CHEMBL243677 IC50 = 8700.0 nM 5.06
CHEMBL1277701 IC50 = 10200.0 nM 4.99
CHEMBL163316 3-O-METHYLQUERCETIN IC50 = 10800.0 nM 4.97
CHEMBL8260 BAICALEIN IC50 = 11800.0 nM 4.93
CHEMBL151 LUTEOLIN IC50 = 12700.0 nM 4.90
CHEMBL150 KAEMPFEROL IC50 = 12700.0 nM 4.90
CHEMBL5418159 IC50 = 13800.0 nM 4.86
CHEMBL117 CHRYSIN IC50 = 14800.0 nM 4.83
CHEMBL5272459 IC50 = 14700.0 nM 4.83
CHEMBL50 QUERCETIN IC50 = 15800.0 nM 4.80
CHEMBL165064 ISOKAEMPFERIDE IC50 = 16100.0 nM 4.79
CHEMBL28 APIGENIN IC50 = 22200.0 nM 4.65
CHEMBL5279962 IC50 = 26500.0 nM 4.58
CHEMBL301624 IC50 = 27000.0 nM 4.57
CHEMBL222556 IC50 = 30500.0 nM 4.52
CHEMBL3326852 IC50 = 33500.0 nM 4.47
CHEMBL3326854 IC50 = 62400.0 nM 4.21
CHEMBL5280903 IC50 = 84600.0 nM 4.07
CHEMBL5284680 IC50 = 87500.0 nM 4.06
CHEMBL5271510 IC50 = 87100.0 nM 4.06
CHEMBL44 GENISTEIN IC50 = 92400.0 nM 4.03
CHEMBL5440374 IC50 = 98300.0 nM 4.01
CHEMBL228623 IC50 > 100000.0 nM -
CHEMBL5284676 IC50 > 100000.0 nM -
CHEMBL5281399 IC50 > 100000.0 nM -
CHEMBL226507 SINENSETIN IC50 > 100000.0 nM -
CHEMBL5418637 IC50 > 100000.0 nM -
CHEMBL5409887 IC50 > 100000.0 nM -
CHEMBL5435484 IC50 > 100000.0 nM -
CHEMBL5419567 IC50 > 100000.0 nM -
CHEMBL5411625 IC50 > 100000.0 nM -
CHEMBL5403947 IC50 > 100000.0 nM -
CHEMBL594248 IC50 > 100000.0 nM -