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Assay Detail

CHEMBL4835003

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

Binding
Inhibition of SAE in human HCT116 cells assessed as redistribution of SUMO2/3 proteins from nucleus to cytosol preincubated for 2 hrs followed by compound washout and measured immediately by immunofluorescence assay
26
Total Activities
25
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type HCT-116
Confidence 7 — Homologous single protein target
Curated By Autocuration

Target

SUMO-activating enzyme (CHEMBL2095174)
Type PROTEIN COMPLEX
Organism Homo sapiens

Publication

Discovery of TAK-981, a First-in-Class Inhibitor of SUMO-Activating Enzyme for the Treatment of Cancer.
Langston SP, Grossman S, England D, Afroze R, Bence N, Bowman D, Bump N, Chau R, Chuang BC, Claiborne C, Cohen L, Connolly K, Duffey M, Durvasula N, Freeze S, Gallery M, Galvin K, Gaulin J, Gershman R, Greenspan P, Grieves J, Guo J, Gulavita N, Hailu S, He X, Hoar K, Hu Y, Hu Z, Ito M, Kim MS, Lane SW, Lok D, Lublinsky A, Mallender W, McIntyre C, Minissale J, Mizutani H, Mizutani M, Molchinova N, Ono K, Patil A, Qian M, Riceberg J, Shindi V, Sintchak MD, Song K, Soucy T, Wang Y, Xu H, Yang X, Zawadzka A, Zhang J, Pulukuri SM.
J Med Chem (2021) 64 : 2501 -2520
PubMed 33631934 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 26 7.47 8.40

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4848140 1 8.40
CHEMBL4848114 1 8.30
CHEMBL4861509 1 8.15
CHEMBL4848442 1 8.10
CHEMBL4873956 1 8.05
CHEMBL4849766 1 8.00
CHEMBL4864361 1 7.80
CHEMBL4852516 1 7.77
CHEMBL4877684 1 7.77
CHEMBL4858933 1 7.75
CHEMBL4873487 1 7.72
CHEMBL4850183 1 7.72
CHEMBL4854038 1 7.72
CHEMBL4870385 1 7.60
CHEMBL4860917 1 7.54
CHEMBL4862901 1 7.50
CHEMBL4860263 2 7.37
CHEMBL4855964 1 7.28
CHEMBL4860960 1 7.18
CHEMBL4862248 1 7.08
CHEMBL4853360 1 6.85
CHEMBL4856040 1 6.78
CHEMBL4872222 1 6.74
CHEMBL4878832 1 6.60
CHEMBL4865157 1 6.44

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4848140 IC50 = 4.0 nM 8.40
CHEMBL4848114 IC50 = 5.0 nM 8.30
CHEMBL4861509 IC50 = 7.0 nM 8.15
CHEMBL4848442 IC50 = 8.0 nM 8.10
CHEMBL4873956 IC50 = 9.0 nM 8.05
CHEMBL4849766 IC50 = 10.0 nM 8.00
CHEMBL4864361 IC50 = 16.0 nM 7.80
CHEMBL4852516 IC50 = 17.0 nM 7.77
CHEMBL4877684 IC50 = 17.0 nM 7.77
CHEMBL4858933 IC50 = 18.0 nM 7.75
CHEMBL4854038 IC50 = 19.0 nM 7.72
CHEMBL4873487 IC50 = 19.0 nM 7.72
CHEMBL4850183 IC50 = 19.0 nM 7.72
CHEMBL4870385 IC50 = 25.0 nM 7.60
CHEMBL4860917 IC50 = 29.0 nM 7.54
CHEMBL4862901 IC50 = 32.0 nM 7.50
CHEMBL4860263 IC50 = 43.0 nM 7.37
CHEMBL4855964 IC50 = 52.0 nM 7.28
CHEMBL4860960 IC50 = 66.0 nM 7.18
CHEMBL4862248 IC50 = 83.0 nM 7.08
CHEMBL4853360 IC50 = 142.0 nM 6.85
CHEMBL4856040 IC50 = 167.0 nM 6.78
CHEMBL4872222 IC50 = 184.0 nM 6.74
CHEMBL4878832 IC50 = 251.0 nM 6.60
CHEMBL4865157 IC50 = 365.0 nM 6.44
CHEMBL4860263 IC50 = 1210.0 nM 5.92