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Assay Detail

CHEMBL4843961

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

ADMET
Inhibition of recombinant human HDAC6 using ZMAL as substrate incubated for 90 mins by fluorescence based micro plate assay
12
Total Activities
12
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Histone deacetylase 6 (CHEMBL1865)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Synthesis, structure-activity relationships, cocrystallization and cellular characterization of novel smHDAC8 inhibitors for the treatment of schistosomiasis.
Ghazy E, Heimburg T, Lancelot J, Zeyen P, Schmidtkunz K, Truhn A, Darwish S, Simoben CV, Shaik TB, Erdmann F, Schmidt M, Robaa D, Romier C, Jung M, Pierce R, Sippl W.
Eur J Med Chem (2021) 225 : 113745 -113745
PubMed 34392190 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 12 6.43 7.70

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4852163 1 7.70
CHEMBL4870316 1 7.70
CHEMBL98 VORINOSTAT 4.0 1 7.40
CHEMBL4870162 1 6.96
CHEMBL4870946 1 6.92
CHEMBL4857763 1 6.80
CHEMBL4847326 1 6.54
CHEMBL4065863 1 6.22
CHEMBL4853162 1 5.82
CHEMBL4849600 1 5.62
CHEMBL4867041 1 5.11
CHEMBL3800394 1 4.41

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4852163 IC50 = 20.0 nM 7.70
CHEMBL4870316 IC50 = 20.0 nM 7.70
CHEMBL98 VORINOSTAT IC50 = 40.0 nM 7.40
CHEMBL4870162 IC50 = 110.0 nM 6.96
CHEMBL4870946 IC50 = 120.0 nM 6.92
CHEMBL4857763 IC50 = 160.0 nM 6.80
CHEMBL4847326 IC50 = 290.0 nM 6.54
CHEMBL4065863 IC50 = 600.0 nM 6.22
CHEMBL4853162 IC50 = 1500.0 nM 5.82
CHEMBL4849600 IC50 = 2400.0 nM 5.62
CHEMBL4867041 IC50 = 7740.0 nM 5.11
CHEMBL3800394 IC50 = 39000.0 nM 4.41