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Assay Detail

CHEMBL4818543

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

Binding
Inhibition of recombinant human FLAG-tagged HDAC3 expressed in human HEK293F cells co-expressing His6-tagged SMRT (1 to 899 residues) using Fluor-de-lys substrate as substrate incubated for 3 hrs followed by substrate addition and measured after 60 mins by fluorescence based assay
17
Total Activities
17
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type HEK293F
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

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

Publication

Redefining the Histone Deacetylase Inhibitor Pharmacophore: High Potency with No Zinc Cofactor Interaction.
Beshore DC, Adam GC, Barnard RJO, Burlein C, Gallicchio SN, Holloway MK, Krosky D, Lemaire W, Myers RW, Patel S, Plotkin MA, Powell DA, Rada V, Cox CD, Coleman PJ, Klein DJ, Wolkenberg SE.
ACS Med Chem Lett (2021) 12 : 540 -547
PubMed 33854701 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 17 6.88 9.22

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2448576 1 9.22
CHEMBL4873847 1 8.77
CHEMBL4867665 1 8.33
CHEMBL408513 BELINOSTAT 4.0 1 8.14
CHEMBL4879154 1 7.75
CHEMBL98 VORINOSTAT 4.0 1 7.54
CHEMBL4861270 1 7.26
CHEMBL4851511 1 6.80
CHEMBL4872186 1 6.68
CHEMBL4862719 1 6.52
CHEMBL4874919 1 6.47
CHEMBL4858081 1 6.44
CHEMBL4877454 1 5.46
CHEMBL4878011 1 5.28
CHEMBL4855240 1 4.82
CHEMBL4859130 1 4.55
CHEMBL4851062 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2448576 IC50 = 0.6 nM 9.22
CHEMBL4873847 IC50 = 1.7 nM 8.77
CHEMBL4867665 IC50 = 4.7 nM 8.33
CHEMBL408513 BELINOSTAT IC50 = 7.3 nM 8.14
CHEMBL4879154 IC50 = 18.0 nM 7.75
CHEMBL98 VORINOSTAT IC50 = 29.0 nM 7.54
CHEMBL4861270 IC50 = 55.2 nM 7.26
CHEMBL4851511 IC50 = 160.0 nM 6.80
CHEMBL4872186 IC50 = 210.0 nM 6.68
CHEMBL4862719 IC50 = 300.0 nM 6.52
CHEMBL4874919 IC50 = 340.0 nM 6.47
CHEMBL4858081 IC50 = 360.0 nM 6.44
CHEMBL4877454 IC50 = 3500.0 nM 5.46
CHEMBL4878011 IC50 = 5200.0 nM 5.28
CHEMBL4855240 IC50 = 15000.0 nM 4.82
CHEMBL4859130 IC50 = 28000.0 nM 4.55
CHEMBL4851062 IC50 > 50000.0 nM -