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Assay Detail

CHEMBL3860992

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

ADMET
Inhibition of full length recombinant human C-terminal His-tagged HDAC2 expressed in baculovirus infected Sf9 cells using fluorogenic HDAC substrate after 30 mins by fluorescence analysis
47
Total Activities
47
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 2 (CHEMBL1937)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Design, Synthesis, and Biological Evaluation of First-in-Class Dual Acting Histone Deacetylases (HDACs) and Phosphodiesterase 5 (PDE5) Inhibitors for the Treatment of Alzheimer's Disease.
Rabal O, Sánchez-Arias JA, Cuadrado-Tejedor M, de Miguel I, Pérez-González M, García-Barroso C, Ugarte A, Estella-Hermoso de Mendoza A, Sáez E, Espelosin M, Ursua S, Haizhong T, Wei W, Musheng X, Garcia-Osta A, Oyarzabal J.
J Med Chem (2016) 59 : 8967 -9004
PubMed 27606546 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 47 5.85 7.05

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3923840 1 7.05
CHEMBL3970984 1 6.93
CHEMBL3979179 1 6.78
CHEMBL3895838 1 6.47
CHEMBL3986487 1 6.47
CHEMBL3936651 1 6.37
CHEMBL3907730 1 6.31
CHEMBL3900593 1 6.31
CHEMBL3978271 1 6.15
CHEMBL3955253 1 6.14
CHEMBL3982024 1 5.91
CHEMBL3925737 1 5.88
CHEMBL3984639 1 5.73
CHEMBL3901988 1 5.73
CHEMBL3982925 1 5.73
CHEMBL3954968 1 5.71
CHEMBL3962991 1 5.69
CHEMBL3974954 1 5.65
CHEMBL3926754 1 5.33
CHEMBL3914813 1 5.19
CHEMBL3899814 1 5.16
CHEMBL3945565 1 5.01
CHEMBL3944571 1 4.86
CHEMBL3962031 1 4.85
CHEMBL3969922 1 4.76
CHEMBL3940720 1 -
CHEMBL3895860 1 -
CHEMBL3893017 1 -
CHEMBL3973027 1 -
CHEMBL3908767 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3923840 IC50 = 89.0 nM 7.05
CHEMBL3970984 IC50 = 117.0 nM 6.93
CHEMBL3979179 IC50 = 166.0 nM 6.78
CHEMBL3895838 IC50 = 335.0 nM 6.47
CHEMBL3986487 IC50 = 341.0 nM 6.47
CHEMBL3936651 IC50 = 432.0 nM 6.37
CHEMBL3907730 IC50 = 490.0 nM 6.31
CHEMBL3900593 IC50 = 490.0 nM 6.31
CHEMBL3978271 IC50 = 712.0 nM 6.15
CHEMBL3955253 IC50 = 729.0 nM 6.14
CHEMBL3982024 IC50 = 1220.0 nM 5.91
CHEMBL3925737 IC50 = 1310.0 nM 5.88
CHEMBL3901988 IC50 = 1860.0 nM 5.73
CHEMBL3982925 IC50 = 1850.0 nM 5.73
CHEMBL3984639 IC50 = 1870.0 nM 5.73
CHEMBL3954968 IC50 = 1940.0 nM 5.71
CHEMBL3962991 IC50 = 2030.0 nM 5.69
CHEMBL3974954 IC50 = 2250.0 nM 5.65
CHEMBL3926754 IC50 = 4640.0 nM 5.33
CHEMBL3914813 IC50 = 6430.0 nM 5.19
CHEMBL3899814 IC50 = 6970.0 nM 5.16
CHEMBL3945565 IC50 = 9830.0 nM 5.01
CHEMBL3944571 IC50 = 13900.0 nM 4.86
CHEMBL3962031 IC50 = 14100.0 nM 4.85
CHEMBL3969922 IC50 = 17500.0 nM 4.76
CHEMBL3890386 IC50 > 20000.0 nM -
CHEMBL3897643 IC50 > 20000.0 nM -
CHEMBL3898715 IC50 > 20000.0 nM -
CHEMBL3950140 IC50 > 20000.0 nM -
CHEMBL3894057 IC50 > 20000.0 nM -
CHEMBL3954259 IC50 > 20000.0 nM -
CHEMBL3966438 IC50 > 20000.0 nM -
CHEMBL3927691 IC50 > 20000.0 nM -
CHEMBL3955306 IC50 > 20000.0 nM -
CHEMBL3932796 IC50 > 20000.0 nM -
CHEMBL3904785 IC50 > 20000.0 nM -
CHEMBL3955289 IC50 > 20000.0 nM -
CHEMBL3976546 IC50 > 20000.0 nM -
CHEMBL3970271 IC50 > 20000.0 nM -
CHEMBL3898716 IC50 > 20000.0 nM -
CHEMBL3956031 IC50 > 20000.0 nM -
CHEMBL3936720 IC50 > 20000.0 nM -
CHEMBL3908767 IC50 > 20000.0 nM -
CHEMBL3973027 IC50 > 20000.0 nM -
CHEMBL3893017 IC50 > 20000.0 nM -
CHEMBL3895860 IC50 > 20000.0 nM -
CHEMBL3940720 IC50 > 20000.0 nM -