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Assay Detail

CHEMBL4835774

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

Binding
Inhibition of His6-tagged/TEV fused SIRT2 (unknown origin) expressed in Escherichia coli BL21 (DE3) preincubated for 15 mins followed by NAD+ addition and measured after 30 mins by FLucK529Ac based luminescence assay
63
Total Activities
61
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

NAD-dependent protein deacetylase sirtuin-2 (CHEMBL4462)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of Dihydro-1,4-Benzoxazine Carboxamides as Potent and Highly Selective Inhibitors of Sirtuin-1.
Spinck M, Bischoff M, Lampe P, Meyer-Almes FJ, Sievers S, Neumann H.
J Med Chem (2021) 64 : 5838 -5849
PubMed 33876629 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 63 4.84 6.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL420311 1 6.30
CHEMBL4868419 1 6.28
CHEMBL4861853 1 6.22
CHEMBL4876108 1 5.75
CHEMBL4876032 1 5.38
CHEMBL4858009 1 4.97
CHEMBL4846832 1 4.95
CHEMBL4876979 1 4.91
CHEMBL4861333 1 4.81
CHEMBL4874547 1 4.78
CHEMBL4847107 1 4.65
CHEMBL4846802 1 4.64
CHEMBL4874493 1 4.60
CHEMBL4862252 1 4.58
CHEMBL4874876 1 4.50
CHEMBL4871146 1 4.49
CHEMBL4855963 3 4.47
CHEMBL4863826 1 4.47
CHEMBL4866570 1 4.46
CHEMBL4862410 1 4.45
CHEMBL4856119 1 4.44
CHEMBL4855315 1 4.38
CHEMBL4863048 1 4.38
CHEMBL4863020 1 4.24
CHEMBL4860158 1 -
CHEMBL4875920 1 -
CHEMBL4845789 1 -
CHEMBL4850398 1 -
CHEMBL4849744 1 -
CHEMBL4860603 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL420311 IC50 = 500.0 nM 6.30
CHEMBL4868419 IC50 = 520.0 nM 6.28
CHEMBL4861853 IC50 = 600.0 nM 6.22
CHEMBL4876108 IC50 = 1760.0 nM 5.75
CHEMBL4876032 IC50 = 4190.0 nM 5.38
CHEMBL4858009 IC50 = 10600.0 nM 4.97
CHEMBL4846832 IC50 = 11200.0 nM 4.95
CHEMBL4876979 IC50 = 12300.0 nM 4.91
CHEMBL4861333 IC50 = 15400.0 nM 4.81
CHEMBL4874547 IC50 = 16600.0 nM 4.78
CHEMBL4847107 IC50 = 22200.0 nM 4.65
CHEMBL4846802 IC50 = 22800.0 nM 4.64
CHEMBL4874493 IC50 = 25000.0 nM 4.60
CHEMBL4862252 IC50 = 26000.0 nM 4.58
CHEMBL4874876 IC50 = 31800.0 nM 4.50
CHEMBL4871146 IC50 = 32600.0 nM 4.49
CHEMBL4855963 IC50 = 34000.0 nM 4.47
CHEMBL4863826 IC50 = 33600.0 nM 4.47
CHEMBL4866570 IC50 = 34700.0 nM 4.46
CHEMBL4862410 IC50 = 35400.0 nM 4.45
CHEMBL4856119 IC50 = 36100.0 nM 4.44
CHEMBL4855963 IC50 = 37700.0 nM 4.42
CHEMBL4855315 IC50 = 41900.0 nM 4.38
CHEMBL4863048 IC50 = 42000.0 nM 4.38
CHEMBL4855963 IC50 = 47300.0 nM 4.33
CHEMBL4863020 IC50 = 58000.0 nM 4.24
CHEMBL4853946 IC50 > 60000.0 nM -
CHEMBL4847736 IC50 > 60000.0 nM -
CHEMBL4852582 IC50 > 60000.0 nM -
CHEMBL4858490 IC50 > 60000.0 nM -
CHEMBL4879347 IC50 > 60000.0 nM -
CHEMBL4867773 IC50 > 60000.0 nM -
CHEMBL4870792 IC50 > 60000.0 nM -
CHEMBL4873507 IC50 > 60000.0 nM -
CHEMBL4857553 IC50 > 60000.0 nM -
CHEMBL4872699 IC50 > 60000.0 nM -
CHEMBL4860536 IC50 > 60000.0 nM -
CHEMBL4852298 IC50 > 60000.0 nM -
CHEMBL4875158 IC50 > 60000.0 nM -
CHEMBL4875507 IC50 > 60000.0 nM -
CHEMBL4878754 IC50 > 60000.0 nM -
CHEMBL4865218 IC50 > 60000.0 nM -
CHEMBL4860158 IC50 > 60000.0 nM -
CHEMBL4845789 IC50 > 60000.0 nM -
CHEMBL4873836 IC50 > 60000.0 nM -
CHEMBL4850398 IC50 > 60000.0 nM -
CHEMBL4869708 IC50 > 60000.0 nM -
CHEMBL4849744 IC50 > 60000.0 nM -
CHEMBL4860603 IC50 > 60000.0 nM -
CHEMBL4862058 IC50 > 60000.0 nM -