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Assay Detail

CHEMBL4054429

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

Binding
Inhibition of N-terminal His-tagged recombinant human SIRT-2 expressed in Escherichia coli using Fluor-de-Lys-SIRT1 as substrate after 15 mins by fluorescence assay
12
Total Activities
12
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 and Characterization of R/S-N-3-Cyanophenyl-N'-(6-tert-butoxycarbonylamino-3,4-dihydro-2,2-dimethyl-2H-1-benzopyran-4-yl)urea, a New Histone Deacetylase Class III Inhibitor Exerting Antiproliferative Activity against Cancer Cell Lines.
Schnekenburger M, Goffin E, Lee JY, Jang JY, Mazumder A, Ji S, Rogister B, Bouider N, Lefranc F, Miklos W, Mathieu V, de Tullio P, Kim KW, Dicato M, Berger W, Han BW, Kiss R, Pirotte B, Diederich M.
J Med Chem (2017) 60 : 4714 -4733
PubMed 28475330 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 12 4.68 5.55

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL224864 1 5.55
CHEMBL4102380 1 5.38
CHEMBL265502 SURAMIN 3.0 1 4.89
CHEMBL4074207 1 4.73
CHEMBL420311 1 4.70
CHEMBL4059756 1 4.64
CHEMBL380797 SIRTINOL 1 4.33
CHEMBL4104634 1 4.31
CHEMBL4090805 1 4.29
CHEMBL4084417 1 4.00
CHEMBL4092171 1 -
CHEMBL608379 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL224864 IC50 = 2800.0 nM 5.55
CHEMBL4102380 IC50 = 4200.0 nM 5.38
CHEMBL265502 SURAMIN IC50 = 13000.0 nM 4.89
CHEMBL4074207 IC50 = 18500.0 nM 4.73
CHEMBL420311 IC50 = 20100.0 nM 4.70
CHEMBL4059756 IC50 = 22700.0 nM 4.64
CHEMBL380797 SIRTINOL IC50 = 47100.0 nM 4.33
CHEMBL4104634 IC50 = 49400.0 nM 4.31
CHEMBL4090805 IC50 = 51100.0 nM 4.29
CHEMBL4084417 IC50 = 99800.0 nM 4.00
CHEMBL4092171 IC50 = 110200.0 nM -
CHEMBL608379 IC50 > 200000.0 nM -