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Assay Detail

CHEMBL4358488

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

Binding
Inhibition of BTK in vitamin D3 differentiated human THP1 cells assessed as inhibition of FCgammaR-induced IL8 production measured after 24 hrs by HTRF assay
28
Total Activities
28
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

Tyrosine-protein kinase BTK (CHEMBL5251)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of LOU064 (Remibrutinib), a Potent and Highly Selective Covalent Inhibitor of Bruton's Tyrosine Kinase.
Angst D, Gessier F, Janser P, Vulpetti A, Wälchli R, Beerli C, Littlewood-Evans A, Dawson J, Nuesslein-Hildesheim B, Wieczorek G, Gutmann S, Scheufler C, Hinniger A, Zimmerlin A, Funhoff EG, Pulz R, Cenni B.
J Med Chem (2020) 63 : 5102 -5118
PubMed 32083858 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 28 7.53 8.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4483575 REMIBRUTINIB 3.0 1 8.60
CHEMBL4439622 1 8.30
CHEMBL4576902 1 8.30
CHEMBL4297674 BRANEBRUTINIB 2.0 1 8.22
CHEMBL4471613 1 8.19
CHEMBL4537231 1 8.05
CHEMBL4559123 1 7.96
CHEMBL4546324 1 7.96
CHEMBL4445790 1 7.92
CHEMBL4450082 1 7.82
CHEMBL1873475 IBRUTINIB 4.0 1 7.80
CHEMBL4550284 1 7.77
CHEMBL4463650 1 7.77
CHEMBL4557061 1 7.75
CHEMBL4567040 1 7.70
CHEMBL4463185 1 7.62
CHEMBL3707348 ACALABRUTINIB 4.0 1 7.62
CHEMBL4071161 TIRABRUTINIB 4.0 1 7.58
CHEMBL4437701 1 7.50
CHEMBL4591291 1 7.22
CHEMBL4072833 EVOBRUTINIB 3.0 1 7.21
CHEMBL4441128 1 7.12
CHEMBL4513614 1 6.97
CHEMBL4576801 1 6.58
CHEMBL4461398 1 6.17
CHEMBL4589396 1 5.84
CHEMBL4468095 1 5.73
CHEMBL4468719 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4483575 REMIBRUTINIB IC50 = 2.5 nM 8.60
CHEMBL4439622 IC50 = 5.0 nM 8.30
CHEMBL4576902 IC50 = 5.0 nM 8.30
CHEMBL4297674 BRANEBRUTINIB IC50 = 6.0 nM 8.22
CHEMBL4471613 IC50 = 6.5 nM 8.19
CHEMBL4537231 IC50 = 9.0 nM 8.05
CHEMBL4559123 IC50 = 11.0 nM 7.96
CHEMBL4546324 IC50 = 11.0 nM 7.96
CHEMBL4445790 IC50 = 12.0 nM 7.92
CHEMBL4450082 IC50 = 15.0 nM 7.82
CHEMBL1873475 IBRUTINIB IC50 = 16.0 nM 7.80
CHEMBL4550284 IC50 = 17.0 nM 7.77
CHEMBL4463650 IC50 = 17.0 nM 7.77
CHEMBL4557061 IC50 = 18.0 nM 7.75
CHEMBL4567040 IC50 = 20.0 nM 7.70
CHEMBL4463185 IC50 = 24.0 nM 7.62
CHEMBL3707348 ACALABRUTINIB IC50 = 24.0 nM 7.62
CHEMBL4071161 TIRABRUTINIB IC50 = 26.0 nM 7.58
CHEMBL4437701 IC50 = 32.0 nM 7.50
CHEMBL4591291 IC50 = 60.0 nM 7.22
CHEMBL4072833 EVOBRUTINIB IC50 = 61.0 nM 7.21
CHEMBL4441128 IC50 = 76.0 nM 7.12
CHEMBL4513614 IC50 = 108.0 nM 6.97
CHEMBL4576801 IC50 = 263.0 nM 6.58
CHEMBL4461398 IC50 = 671.0 nM 6.17
CHEMBL4589396 IC50 = 1437.0 nM 5.84
CHEMBL4468095 IC50 = 1869.0 nM 5.73
CHEMBL4468719 IC50 > 10000.0 nM -