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Assay Detail

CHEMBL5163975

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

Binding
Inhibition of HDAC1 (unknown origin) using trypsin and LGK(Ac)-AMC as substrates incubated for 1 hr and measured by fluorescence assay
44
Total Activities
44
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

Dual-acting antitumor agents targeting the A<sub>2A</sub> adenosine receptor and histone deacetylases: Design and synthesis of 4-(furan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-6-amine derivatives.
Zhang J, Luo Z, Duan W, Yang K, Ling L, Yan W, Liu R, Wüthrich K, Jiang H, Xie C, Cheng J.
Eur J Med Chem (2022) 236 : 114326 -114326
PubMed 35390714 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 44 7.26 8.66

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5169828 1 8.66
CHEMBL5197839 1 8.62
CHEMBL5185100 1 8.15
CHEMBL5202905 1 8.14
CHEMBL5205993 1 8.14
CHEMBL5208818 1 8.08
CHEMBL5207324 1 8.03
CHEMBL5169338 1 8.03
CHEMBL5190098 1 7.96
CHEMBL5209296 1 7.89
CHEMBL5170997 1 7.85
CHEMBL5190589 1 7.84
CHEMBL5184684 1 7.76
CHEMBL5201523 1 7.73
CHEMBL98 VORINOSTAT 4.0 1 7.68
CHEMBL5188801 1 7.64
CHEMBL5171672 1 7.53
CHEMBL5195323 1 7.43
CHEMBL5179765 1 7.37
CHEMBL5204735 1 7.35
CHEMBL5171122 1 7.35
CHEMBL5201509 1 7.19
CHEMBL5200340 1 7.13
CHEMBL5189051 1 7.07
CHEMBL272980 MOCETINOSTAT 2.0 1 7.06
CHEMBL5186576 1 7.02
CHEMBL5203443 1 6.98
CHEMBL5207247 1 6.93
CHEMBL5176483 1 6.90
CHEMBL5193403 1 6.90

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5169828 IC50 = 2.2 nM 8.66
CHEMBL5197839 IC50 = 2.4 nM 8.62
CHEMBL5185100 IC50 = 7.1 nM 8.15
CHEMBL5202905 IC50 = 7.2 nM 8.14
CHEMBL5205993 IC50 = 7.3 nM 8.14
CHEMBL5208818 IC50 = 8.4 nM 8.08
CHEMBL5207324 IC50 = 9.3 nM 8.03
CHEMBL5169338 IC50 = 9.3 nM 8.03
CHEMBL5190098 IC50 = 11.1 nM 7.96
CHEMBL5209296 IC50 = 12.8 nM 7.89
CHEMBL5170997 IC50 = 14.0 nM 7.85
CHEMBL5190589 IC50 = 14.5 nM 7.84
CHEMBL5184684 IC50 = 17.5 nM 7.76
CHEMBL5201523 IC50 = 18.5 nM 7.73
CHEMBL98 VORINOSTAT IC50 = 21.0 nM 7.68
CHEMBL5188801 IC50 = 23.0 nM 7.64
CHEMBL5171672 IC50 = 29.5 nM 7.53
CHEMBL5195323 IC50 = 37.0 nM 7.43
CHEMBL5179765 IC50 = 42.5 nM 7.37
CHEMBL5204735 IC50 = 45.0 nM 7.35
CHEMBL5171122 IC50 = 45.0 nM 7.35
CHEMBL5201509 IC50 = 64.5 nM 7.19
CHEMBL5200340 IC50 = 73.5 nM 7.13
CHEMBL5189051 IC50 = 86.0 nM 7.07
CHEMBL272980 MOCETINOSTAT IC50 = 86.3 nM 7.06
CHEMBL5186576 IC50 = 95.0 nM 7.02
CHEMBL5203443 IC50 = 105.0 nM 6.98
CHEMBL5207247 IC50 = 116.5 nM 6.93
CHEMBL5176483 IC50 = 126.3 nM 6.90
CHEMBL5193403 IC50 = 126.5 nM 6.90
CHEMBL5199428 IC50 = 145.3 nM 6.84
CHEMBL5171906 IC50 = 151.0 nM 6.82
CHEMBL5202005 IC50 = 185.5 nM 6.73
CHEMBL5205560 IC50 = 190.0 nM 6.72
CHEMBL5188108 IC50 = 192.0 nM 6.72
CHEMBL5196802 IC50 = 205.5 nM 6.69
CHEMBL5189321 IC50 = 210.0 nM 6.68
CHEMBL5190722 IC50 = 226.0 nM 6.65
CHEMBL5192939 IC50 = 228.0 nM 6.64
CHEMBL5194109 IC50 = 394.0 nM 6.41
CHEMBL5200632 IC50 = 419.5 nM 6.38
CHEMBL5179716 IC50 = 573.5 nM 6.24
CHEMBL5173073 IC50 = 1175.5 nM 5.93
CHEMBL5194232 IC50 = 2532.0 nM 5.60