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Assay Detail

CHEMBL4673064

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

Binding
Inhibition of His-tagged IRE1alpha D688N mutant KR domain (G547 to L997 reidues) (unknown origin) expressed in Sf9 insect cells measured after 1 hr by fluorescent labeled probe based TR-FRET assay
22
Total Activities
22
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Identification of BRaf-Sparing Amino-Thienopyrimidines with Potent IRE1α Inhibitory Activity.
Beveridge RE,Wallweber HA,Ashkenazi A,Beresini M,Clark KR,Gibbons P,Ghiro E,Kaufman S,Larivée A,Leblanc M,Leclerc JP,Lemire A,Ly C,Rudolph J,Schwarz JB,Srivastava S,Wang W,Zhao L,Braun MG
ACS Med Chem Lett (2020) 11 : 2389 -2396
PubMed 33335661 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 22 7.99 8.48

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4758021 1 8.48
CHEMBL3356007 1 8.43
CHEMBL4755886 1 8.43
CHEMBL4760343 1 8.41
CHEMBL4781285 1 8.36
CHEMBL4754759 1 8.31
CHEMBL4757144 1 8.30
CHEMBL4759829 1 8.29
CHEMBL4786638 1 8.29
CHEMBL4747176 1 8.28
CHEMBL4752754 1 8.28
CHEMBL4749470 1 8.27
CHEMBL4787548 1 8.26
CHEMBL4780489 1 8.17
CHEMBL4758147 1 8.15
CHEMBL4743690 1 8.11
CHEMBL4753548 1 8.05
CHEMBL4753081 1 7.68
CHEMBL4740654 1 7.24
CHEMBL4759055 1 6.85
CHEMBL4749836 1 6.68
CHEMBL4744569 1 6.40

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4758021 IC50 = 3.3 nM 8.48
CHEMBL3356007 IC50 = 3.7 nM 8.43
CHEMBL4755886 IC50 = 3.7 nM 8.43
CHEMBL4760343 IC50 = 3.9 nM 8.41
CHEMBL4781285 IC50 = 4.4 nM 8.36
CHEMBL4754759 IC50 = 4.9 nM 8.31
CHEMBL4757144 IC50 = 5.0 nM 8.30
CHEMBL4759829 IC50 = 5.1 nM 8.29
CHEMBL4786638 IC50 = 5.1 nM 8.29
CHEMBL4747176 IC50 = 5.3 nM 8.28
CHEMBL4752754 IC50 = 5.3 nM 8.28
CHEMBL4749470 IC50 = 5.4 nM 8.27
CHEMBL4787548 IC50 = 5.5 nM 8.26
CHEMBL4780489 IC50 = 6.8 nM 8.17
CHEMBL4758147 IC50 = 7.1 nM 8.15
CHEMBL4743690 IC50 = 7.8 nM 8.11
CHEMBL4753548 IC50 = 8.9 nM 8.05
CHEMBL4753081 IC50 = 21.0 nM 7.68
CHEMBL4740654 IC50 = 58.0 nM 7.24
CHEMBL4759055 IC50 = 140.0 nM 6.85
CHEMBL4749836 IC50 = 210.0 nM 6.68
CHEMBL4744569 IC50 = 400.0 nM 6.40