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Assay Detail

CHEMBL4024938

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

Binding
Reversible inhibition of full length recombinant human N-terminal His tagged BKT expressed in baculovirus infected Sf9 insect cells using poly (Glu,Tyr)4:1 as substrate pretreated for 2 to 60 mins followed by substrate addition after 1 hr by ADP-Glo luminescence assay
8
Total Activities
8
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 N-(3-(5-((3-acrylamido-4-(morpholine-4-carbonyl)phenyl)amino)-1-methyl-6-oxo-1,6-dihydropyridin-3-yl)-2-methylphenyl)-4-(tert-butyl)benzamide (CHMFL-BTK-01) as a highly selective irreversible Bruton's tyrosine kinase (BTK) inhibitor.
Liang Q, Chen Y, Yu K, Chen C, Zhang S, Wang A, Wang W, Wu H, Liu X, Wang B, Wang L, Hu Z, Wang W, Ren T, Zhang S, Liu Q, Yun CH, Liu J.
Eur J Med Chem (2017) 131 : 107 -125
PubMed 28315597 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 8 7.67 8.32

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1873475 IBRUTINIB 4.0 1 8.32
CHEMBL4096207 1 8.22
CHEMBL4077123 1 8.05
CHEMBL4077064 1 7.85
CHEMBL3301625 SPEBRUTINIB 2.0 1 7.68
CHEMBL3290142 1 7.57
CHEMBL4085868 1 6.95
CHEMBL2216827 1 6.68

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1873475 IBRUTINIB Ki = 4.8 nM 8.32
CHEMBL4096207 Ki = 6.0 nM 8.22
CHEMBL4077123 Ki = 8.9 nM 8.05
CHEMBL4077064 Ki = 14.2 nM 7.85
CHEMBL3301625 SPEBRUTINIB Ki = 20.7 nM 7.68
CHEMBL3290142 Ki = 27.2 nM 7.57
CHEMBL4085868 Ki = 113.0 nM 6.95
CHEMBL2216827 Ki = 209.2 nM 6.68