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Assay Detail

CHEMBL3761791

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

Binding
Inhibition of human recombinant HDAC1 using acetyllysine tripeptide coupled with 7-amino-4-methylcoumarin as substrate by fluorescence assay
12
Total Activities
12
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

Histone deacetylase 1 (CHEMBL325)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Dissecting structure-activity-relationships of crebinostat: Brain penetrant HDAC inhibitors for neuroepigenetic regulation.
Ghosh B, Zhao WN, Reis SA, Patnaik D, Fass DM, Tsai LH, Mazitschek R, Haggarty SJ.
Bioorg Med Chem Lett (2016) 26 : 1265 -1271
PubMed 26804233 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 12 8.50 9.22

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3759059 1 9.22
CHEMBL3759921 1 9.15
CHEMBL3759794 1 8.96
CHEMBL3759982 1 8.85
CHEMBL3758735 1 8.68
CHEMBL3758870 1 8.64
CHEMBL3758281 1 8.51
CHEMBL3758492 1 8.49
CHEMBL98 VORINOSTAT 4.0 1 8.15
CHEMBL3758191 1 8.10
CHEMBL3758251 1 7.72
CHEMBL3758246 1 7.50

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3759059 IC50 = 0.6 nM 9.22
CHEMBL3759921 IC50 = 0.7 nM 9.15
CHEMBL3759794 IC50 = 1.1 nM 8.96
CHEMBL3759982 IC50 = 1.4 nM 8.85
CHEMBL3758735 IC50 = 2.1 nM 8.68
CHEMBL3758870 IC50 = 2.3 nM 8.64
CHEMBL3758281 IC50 = 3.1 nM 8.51
CHEMBL3758492 IC50 = 3.2 nM 8.49
CHEMBL98 VORINOSTAT IC50 = 7.0 nM 8.15
CHEMBL3758191 IC50 = 8.0 nM 8.10
CHEMBL3758251 IC50 = 19.0 nM 7.72
CHEMBL3758246 IC50 = 31.4 nM 7.50