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Assay Detail

CHEMBL5732883

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Binding
Inhibition Assay: HDAC inhibition assays can be performed, e.g., in a cell, in a cell extract, or in a cell-free mixture. Exemplary HDAC inhibition assays are described in Pérez-Balado et al., 2007, J. Med. Chem., 50:2497-2505; Herman et al., 2006, Nat. Chem. Biol., 2:551-558; and Beckers et al., 2007, Int. J. Cancer, 121:1138-48.
36
Total Activities
11
Compounds Tested
3
Activity Types
0
Assay Parameters

Assay Information

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

Target

Histone deacetylase 3 (CHEMBL1829)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Compositions including 6-aminohexanoic acid derivatives as HDAC inhibitors
(2017)

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 12 5.80 6.52
kon 12 - -
k_off 12 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3970532 3 6.52
CHEMBL27759 ENTINOSTAT 3.0 3 6.23
CHEMBL3940985 6 6.16
CHEMBL3958365 3 6.10
CHEMBL3953107 3 5.85
CHEMBL3944388 3 5.80
CHEMBL3921933 3 5.75
CHEMBL3920131 3 5.64
CHEMBL3916454 3 5.44
CHEMBL3934253 3 5.14
CHEMBL3930868 3 4.85

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3970532 IC50 = 300.0 nM 6.52
CHEMBL27759 ENTINOSTAT IC50 = 590.0 nM 6.23
CHEMBL3940985 IC50 = 700.0 nM 6.16
CHEMBL3940985 IC50 = 700.0 nM 6.16
CHEMBL3958365 IC50 = 800.0 nM 6.10
CHEMBL3953107 IC50 = 1400.0 nM 5.85
CHEMBL3944388 IC50 = 1600.0 nM 5.80
CHEMBL3921933 IC50 = 1800.0 nM 5.75
CHEMBL3920131 IC50 = 2300.0 nM 5.64
CHEMBL3916454 IC50 = 3600.0 nM 5.44
CHEMBL3934253 IC50 = 7300.0 nM 5.14
CHEMBL3930868 IC50 = 14000.0 nM 4.85
CHEMBL3958365 k_off = - s-1 -
CHEMBL3958365 kon = - -
CHEMBL3920131 k_off = - s-1 -
CHEMBL3920131 kon = - -
CHEMBL3940985 k_off = - s-1 -
CHEMBL3940985 kon = - -
CHEMBL3970532 k_off = - s-1 -
CHEMBL3970532 kon = - -
CHEMBL3940985 k_off = - s-1 -
CHEMBL3940985 kon = - -
CHEMBL27759 ENTINOSTAT k_off = - s-1 -
CHEMBL27759 ENTINOSTAT kon = - -
CHEMBL3930868 kon = - -
CHEMBL3930868 k_off = - s-1 -
CHEMBL3934253 k_off = - s-1 -
CHEMBL3953107 kon = - -
CHEMBL3953107 k_off = - s-1 -
CHEMBL3921933 kon = - -
CHEMBL3934253 kon = - -
CHEMBL3921933 k_off = - s-1 -
CHEMBL3944388 kon = - -
CHEMBL3944388 k_off = - s-1 -
CHEMBL3916454 kon = - -
CHEMBL3916454 k_off = - s-1 -