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Assay Detail

CHEMBL5043204

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

Binding
Inhibition of BTK phosphorylation in human whole blood assessed as reduction in BTK phosphorylation incubated for 30 mins
17
Total Activities
17
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Tissue Blood
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

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

Publication

Discovery and Preclinical Characterization of BIIB091, a Reversible, Selective BTK Inhibitor for the Treatment of Multiple Sclerosis.
Hopkins BT, Bame E, Bajrami B, Black C, Bohnert T, Boiselle C, Burdette D, Burns JC, Delva L, Donaldson D, Grater R, Gu C, Hoemberger M, Johnson J, Kapadnis S, King K, Lulla M, Ma B, Marx I, Magee T, Meissner R, Metrick CM, Mingueneau M, Murugan P, Otipoby KL, Polack E, Poreci U, Prince R, Roach AM, Rowbottom C, Santoro JC, Schroeder P, Tang H, Tien E, Zhang F, Lyssikatos J.
J Med Chem (2022) 65 : 1206 -1224
PubMed 34734694 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 17 7.13 7.89

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5080861 1 7.89
CHEMBL5089327 1 7.85
CHEMBL4066176 1 7.70
CHEMBL5076817 1 7.68
CHEMBL5083772 BIIB-091 2.0 1 7.62
CHEMBL3301625 SPEBRUTINIB 2.0 1 7.40
CHEMBL5090290 1 7.30
CHEMBL5085931 1 7.28
CHEMBL5091935 1 7.22
CHEMBL4209441 SOFNOBRUTINIB 2.0 1 7.05
CHEMBL4744041 1 7.00
CHEMBL3900554 BMS-986142 2.0 1 6.96
CHEMBL5073223 1 6.89
CHEMBL5069979 1 6.82
CHEMBL5087083 1 6.28
CHEMBL5086077 1 6.28
CHEMBL5090623 1 6.01

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5080861 IC50 = 13.0 nM 7.89
CHEMBL5089327 IC50 = 14.0 nM 7.85
CHEMBL4066176 IC50 = 20.0 nM 7.70
CHEMBL5076817 IC50 = 21.0 nM 7.68
CHEMBL5083772 BIIB-091 IC50 = 24.0 nM 7.62
CHEMBL3301625 SPEBRUTINIB IC50 = 40.0 nM 7.40
CHEMBL5090290 IC50 = 50.0 nM 7.30
CHEMBL5085931 IC50 = 52.0 nM 7.28
CHEMBL5091935 IC50 = 60.0 nM 7.22
CHEMBL4209441 SOFNOBRUTINIB IC50 = 90.0 nM 7.05
CHEMBL4744041 IC50 = 100.0 nM 7.00
CHEMBL3900554 BMS-986142 IC50 = 110.0 nM 6.96
CHEMBL5073223 IC50 = 130.0 nM 6.89
CHEMBL5069979 IC50 = 150.0 nM 6.82
CHEMBL5087083 IC50 = 530.0 nM 6.28
CHEMBL5086077 IC50 = 520.0 nM 6.28
CHEMBL5090623 IC50 = 980.0 nM 6.01