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Assay Detail

CHEMBL4031302

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

Binding
Inhibition of C-terminal FLAG His tagged full length human recombinant HDAC1 (1 to 482 residues) expressed in baculovirus infected sf21 cells using RHKKAc as substrate in presence of ATP
10
Total Activities
10
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

Design and Synthesis of Ligand Efficient Dual Inhibitors of Janus Kinase (JAK) and Histone Deacetylase (HDAC) Based on Ruxolitinib and Vorinostat.
Yao L, Mustafa N, Tan EC, Poulsen A, Singh P, Duong-Thi MD, Lee JXT, Ramanujulu PM, Chng WJ, Yen JJY, Ohlson S, Dymock BW.
J Med Chem (2017) 60 : 8336 -8357
PubMed 28953386 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 10 6.78 8.22

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4095596 1 8.22
CHEMBL4060201 1 8.16
CHEMBL4069283 1 7.44
CHEMBL4098975 1 6.96
CHEMBL4060602 1 6.86
CHEMBL4091233 1 6.58
CHEMBL98 VORINOSTAT 4.0 1 6.51
CHEMBL4088824 1 6.07
CHEMBL4059703 1 5.58
CHEMBL4070306 1 5.45

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4095596 IC50 = 6.0 nM 8.22
CHEMBL4060201 IC50 = 6.9 nM 8.16
CHEMBL4069283 IC50 = 36.0 nM 7.44
CHEMBL4098975 IC50 = 110.0 nM 6.96
CHEMBL4060602 IC50 = 138.0 nM 6.86
CHEMBL4091233 IC50 = 265.0 nM 6.58
CHEMBL98 VORINOSTAT IC50 = 306.0 nM 6.51
CHEMBL4088824 IC50 = 854.0 nM 6.07
CHEMBL4059703 IC50 = 2650.0 nM 5.58
CHEMBL4070306 IC50 = 3540.0 nM 5.45