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Assay Detail

CHEMBL5503836

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

Binding
Inhibition of human Sirt2 (56 to 356 residues) deacetylation expressed in Escherichia coli BL21 (DE3) using ZMAL as substrate incubated for 4 hrs in presence of NAD+ by fluorescence based microplate reader assay
15
Total Activities
15
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

Structure-Activity Studies of 1,2,4-Oxadiazoles for the Inhibition of the NAD<sup>+</sup>-Dependent Lysine Deacylase Sirtuin 2.
Colcerasa A, Friedrich F, Melesina J, Moser P, Vogelmann A, Tzortzoglou P, Neuwirt E, Sum M, Robaa D, Zhang L, Ramos-Morales E, Romier C, Einsle O, Metzger E, Schüle R, Groß O, Sippl W, Jung M.
J Med Chem (2024) 67 : 10076 -10095
PubMed 38847803 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 15 6.16 6.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4227437 1 6.92
CHEMBL5558057 1 6.92
CHEMBL5558796 1 6.68
CHEMBL5556332 1 6.46
CHEMBL5531984 1 6.37
CHEMBL5532186 1 6.22
CHEMBL5556968 1 6.21
CHEMBL5512474 1 6.19
CHEMBL5505814 1 6.17
CHEMBL5555774 1 6.06
CHEMBL5505752 1 6.05
CHEMBL5558824 1 5.97
CHEMBL5555401 1 5.96
CHEMBL3431191 1 5.44
CHEMBL5542182 1 4.75

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4227437 IC50 = 120.0 nM 6.92
CHEMBL5558057 IC50 = 120.0 nM 6.92
CHEMBL5558796 IC50 = 210.0 nM 6.68
CHEMBL5556332 IC50 = 350.0 nM 6.46
CHEMBL5531984 IC50 = 430.0 nM 6.37
CHEMBL5532186 IC50 = 600.0 nM 6.22
CHEMBL5556968 IC50 = 620.0 nM 6.21
CHEMBL5512474 IC50 = 640.0 nM 6.19
CHEMBL5505814 IC50 = 670.0 nM 6.17
CHEMBL5555774 IC50 = 880.0 nM 6.06
CHEMBL5505752 IC50 = 900.0 nM 6.05
CHEMBL5558824 IC50 = 1070.0 nM 5.97
CHEMBL5555401 IC50 = 1100.0 nM 5.96
CHEMBL3431191 IC50 = 3600.0 nM 5.44
CHEMBL5542182 IC50 = 17800.0 nM 4.75