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Assay Detail

CHEMBL2340697

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

Binding
Inhibition of human His-tagged SIRT3 (102 to 399) expressed in Escherichia coli BL21(DE3) assessed as inhibition of deacetylation of Ac-RHKKAcW-NH2 substrate preincubated for 20 mins measured after 30 mins by mass spectrophotometric analysis
34
Total Activities
34
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

Publication

Discovery of thieno[3,2-d]pyrimidine-6-carboxamides as potent inhibitors of SIRT1, SIRT2, and SIRT3.
Disch JS, Evindar G, Chiu CH, Blum CA, Dai H, Jin L, Schuman E, Lind KE, Belyanskaya SL, Deng J, Coppo F, Aquilani L, Graybill TL, Cuozzo JW, Lavu S, Mao C, Vlasuk GP, Perni RB.
J Med Chem (2013) 56 : 3666 -3679
PubMed 23570514 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 34 7.08 8.49

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2332041 1 8.49
CHEMBL2332039 1 8.40
CHEMBL2332037 1 8.31
CHEMBL2338810 1 8.14
CHEMBL2332043 1 8.12
CHEMBL2332042 1 7.89
CHEMBL2332040 1 7.64
CHEMBL2332038 1 7.62
CHEMBL2338813 1 7.55
CHEMBL2332044 1 7.54
CHEMBL2338814 1 7.52
CHEMBL2332055 1 7.48
CHEMBL2332052 1 7.41
CHEMBL2332045 1 7.25
CHEMBL2338812 1 7.21
CHEMBL2338808 1 7.17
CHEMBL2338809 1 7.04
CHEMBL2338816 1 6.96
CHEMBL2338818 1 6.82
CHEMBL2332053 1 6.55
CHEMBL2332046 1 6.52
CHEMBL2338811 1 6.43
CHEMBL2332054 1 6.19
CHEMBL2332051 1 6.11
CHEMBL2338815 1 5.89
CHEMBL2338817 1 5.68
CHEMBL2332050 1 5.36
CHEMBL2332047 1 5.07
CHEMBL2332049 1 -
CHEMBL2332048 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2332041 IC50 = 3.2 nM 8.49
CHEMBL2332039 IC50 = 4.0 nM 8.40
CHEMBL2332037 IC50 = 4.9 nM 8.31
CHEMBL2338810 IC50 = 7.2 nM 8.14
CHEMBL2332043 IC50 = 7.6 nM 8.12
CHEMBL2332042 IC50 = 13.0 nM 7.89
CHEMBL2332040 IC50 = 23.0 nM 7.64
CHEMBL2332038 IC50 = 24.0 nM 7.62
CHEMBL2338813 IC50 = 28.0 nM 7.55
CHEMBL2332044 IC50 = 29.0 nM 7.54
CHEMBL2338814 IC50 = 30.0 nM 7.52
CHEMBL2332055 IC50 = 33.0 nM 7.48
CHEMBL2332052 IC50 = 39.0 nM 7.41
CHEMBL2332045 IC50 = 56.0 nM 7.25
CHEMBL2338812 IC50 = 61.0 nM 7.21
CHEMBL2338808 IC50 = 67.0 nM 7.17
CHEMBL2338809 IC50 = 92.0 nM 7.04
CHEMBL2338816 IC50 = 110.0 nM 6.96
CHEMBL2338818 IC50 = 150.0 nM 6.82
CHEMBL2332053 IC50 = 280.0 nM 6.55
CHEMBL2332046 IC50 = 300.0 nM 6.52
CHEMBL2338811 IC50 = 370.0 nM 6.43
CHEMBL2332054 IC50 = 650.0 nM 6.19
CHEMBL2332051 IC50 = 770.0 nM 6.11
CHEMBL2338815 IC50 = 1300.0 nM 5.89
CHEMBL2338817 IC50 = 2100.0 nM 5.68
CHEMBL2332050 IC50 = 4400.0 nM 5.36
CHEMBL2332047 IC50 = 8600.0 nM 5.07
CHEMBL2332049 IC50 > 50000.0 nM -
CHEMBL2332048 IC50 > 50000.0 nM -
CHEMBL420311 IC50 > 50000.0 nM -
CHEMBL2338819 IC50 > 50000.0 nM -
CHEMBL2338820 IC50 > 50000.0 nM -
CHEMBL2338821 IC50 > 50000.0 nM -