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Assay Detail

CHEMBL4048826

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

ADMET
Inhibition of full length recombinant human C-terminal GST-tagged HDAC2 expressed in baculovirus-infected insect cells using RHKK(Ac)AMC as substrate after 60 mins by fluorimeter
24
Total Activities
24
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 2 (CHEMBL1937)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Marbostat-100 Defines a New Class of Potent and Selective Antiinflammatory and Antirheumatic Histone Deacetylase 6 Inhibitors.
Sellmer A, Stangl H, Beyer M, Grünstein E, Leonhardt M, Pongratz H, Eichhorn E, Elz S, Striegl B, Jenei-Lanzl Z, Dove S, Straub RH, Krämer OH, Mahboobi S.
J Med Chem (2018) 61 : 3454 -3477
PubMed 29589441 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 24 6.26 8.45

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL99 TRICHOSTATIN 1.0 1 8.45
CHEMBL4065219 1 7.18
CHEMBL4062190 1 7.15
CHEMBL4084164 1 6.63
CHEMBL4100534 1 6.51
CHEMBL4072045 1 6.50
CHEMBL4101480 1 6.43
CHEMBL4065283 1 6.33
CHEMBL4075722 1 6.32
CHEMBL4085143 1 6.12
CHEMBL4087616 1 6.11
CHEMBL4083713 1 6.03
CHEMBL4073813 1 6.00
CHEMBL4074800 1 5.87
CHEMBL4066262 1 5.50
CHEMBL4092880 1 5.28
CHEMBL4081647 1 5.21
CHEMBL4062461 1 5.14
CHEMBL4103079 1 -
CHEMBL3110004 1 -
CHEMBL4092802 1 -
CHEMBL4082520 1 -
CHEMBL2018302 TUBASTATIN A 1 -
CHEMBL4100615 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL99 TRICHOSTATIN Ki = 3.55 nM 8.45
CHEMBL4065219 Ki = 66.51 nM 7.18
CHEMBL4062190 Ki = 70.8 nM 7.15
CHEMBL4084164 Ki = 234.0 nM 6.63
CHEMBL4100534 Ki = 310.0 nM 6.51
CHEMBL4072045 Ki = 313.0 nM 6.50
CHEMBL4101480 Ki = 370.0 nM 6.43
CHEMBL4065283 Ki = 469.0 nM 6.33
CHEMBL4075722 Ki = 484.0 nM 6.32
CHEMBL4085143 Ki = 768.0 nM 6.12
CHEMBL4087616 Ki = 774.0 nM 6.11
CHEMBL4083713 Ki = 943.0 nM 6.03
CHEMBL4073813 Ki = 995.0 nM 6.00
CHEMBL4074800 Ki = 1356.0 nM 5.87
CHEMBL4066262 Ki = 3195.0 nM 5.50
CHEMBL4092880 Ki = 5205.0 nM 5.28
CHEMBL4081647 Ki = 6097.0 nM 5.21
CHEMBL4062461 Ki = 7244.0 nM 5.14
CHEMBL4103079 Ki > 10000.0 nM -
CHEMBL3110004 Ki - -
CHEMBL4092802 Ki - -
CHEMBL4082520 Ki - -
CHEMBL2018302 TUBASTATIN A Ki > 1130.0 nM -
CHEMBL4100615 Ki - -