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Assay Detail

CHEMBL4268534

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ADMET
Inhibition of recombinant full length human N-terminal GST-tagged HDAC6 expressed in baculovirus infected Sf9 insect cells using ZMAL as substrate measured after 90 mins by fluorescence assay
7
Total Activities
7
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Cell Type Sf9
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

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

Publication

One-pot, multi-component synthesis and structure-activity relationships of peptoid-based histone deacetylase (HDAC) inhibitors targeting malaria parasites.
Diedrich D, Stenzel K, Hesping E, Antonova-Koch Y, Gebru T, Duffy S, Fisher G, Schöler A, Meister S, Kurz T, Avery VM, Winzeler EA, Held J, Andrews KT, Hansen FK.
Eur J Med Chem (2018) 158 : 801 -813
PubMed 30245402 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 7 7.38 7.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4162282 1 7.52
CHEMBL4280840 1 7.51
CHEMBL4283545 1 7.50
CHEMBL4278449 1 7.46
CHEMBL98 VORINOSTAT 4.0 1 7.26
CHEMBL4289151 1 7.24
CHEMBL4292530 1 7.19

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4162282 IC50 = 30.0 nM 7.52
CHEMBL4280840 IC50 = 31.0 nM 7.51
CHEMBL4283545 IC50 = 32.0 nM 7.50
CHEMBL4278449 IC50 = 35.0 nM 7.46
CHEMBL98 VORINOSTAT IC50 = 55.0 nM 7.26
CHEMBL4289151 IC50 = 57.0 nM 7.24
CHEMBL4292530 IC50 = 64.0 nM 7.19