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Assay Detail

CHEMBL4023698

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

Binding
Inhibition of BTK in human whole blood-derived CD19+ B cells assessed as suppression of anti-IgM stimulated-CD69 expression preincubated for 1 hr followed by IgM stimulation for 18 hrs by FACS analysis
35
Total Activities
33
Compounds Tested
3
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 GDC-0853: A Potent, Selective, and Noncovalent Bruton's Tyrosine Kinase Inhibitor in Early Clinical Development.
Crawford JJ, Johnson AR, Misner DL, Belmont LD, Castanedo G, Choy R, Coraggio M, Dong L, Eigenbrot C, Erickson R, Ghilardi N, Hau J, Katewa A, Kohli PB, Lee W, Lubach JW, McKenzie BS, Ortwine DF, Schutt L, Tay S, Wei B, Reif K, Liu L, Wong H, Young WB.
J Med Chem (2018) 61 : 2227 -2245
PubMed 29457982 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 33 7.41 8.34
IC70 1 - -
IC90 1 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4085043 1 8.34
CHEMBL4065122 FENEBRUTINIB 3.0 3 8.10
CHEMBL4074792 1 7.99
CHEMBL1873475 IBRUTINIB 4.0 1 7.92
CHEMBL4092794 1 7.90
CHEMBL4086408 1 7.81
CHEMBL4087543 1 7.80
CHEMBL4095248 1 7.79
CHEMBL4095379 1 7.77
CHEMBL4069790 1 7.63
CHEMBL3670094 1 7.56
CHEMBL4102992 1 7.56
CHEMBL4090117 1 7.50
CHEMBL4097832 1 7.49
CHEMBL4071754 1 7.48
CHEMBL3670095 1 7.44
CHEMBL4062634 1 7.44
CHEMBL4063638 1 7.41
CHEMBL4066176 1 7.40
CHEMBL4090946 1 7.37
CHEMBL4070991 1 7.29
CHEMBL4085477 1 7.26
CHEMBL4093188 1 7.21
CHEMBL4101904 1 7.19
CHEMBL4060356 1 7.18
CHEMBL4104307 1 7.11
CHEMBL3952795 1 7.05
CHEMBL4071161 TIRABRUTINIB 4.0 1 6.99
CHEMBL4079803 1 6.93
CHEMBL4075845 1 6.92

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4085043 IC50 = 4.6 nM 8.34
CHEMBL4065122 FENEBRUTINIB IC50 = 8.0 nM 8.10
CHEMBL4074792 IC50 = 10.2 nM 7.99
CHEMBL1873475 IBRUTINIB IC50 = 12.0 nM 7.92
CHEMBL4092794 IC50 = 12.7 nM 7.90
CHEMBL4086408 IC50 = 15.4 nM 7.81
CHEMBL4087543 IC50 = 15.9 nM 7.80
CHEMBL4095248 IC50 = 16.1 nM 7.79
CHEMBL4095379 IC50 = 16.9 nM 7.77
CHEMBL4069790 IC50 = 23.5 nM 7.63
CHEMBL3670094 IC50 = 27.6 nM 7.56
CHEMBL4102992 IC50 = 27.5 nM 7.56
CHEMBL4090117 IC50 = 31.6 nM 7.50
CHEMBL4097832 IC50 = 32.2 nM 7.49
CHEMBL4071754 IC50 = 33.4 nM 7.48
CHEMBL3670095 IC50 = 36.5 nM 7.44
CHEMBL4062634 IC50 = 36.6 nM 7.44
CHEMBL4063638 IC50 = 39.0 nM 7.41
CHEMBL4066176 IC50 = 40.0 nM 7.40
CHEMBL4090946 IC50 = 42.4 nM 7.37
CHEMBL4070991 IC50 = 51.5 nM 7.29
CHEMBL4085477 IC50 = 54.9 nM 7.26
CHEMBL4093188 IC50 = 61.9 nM 7.21
CHEMBL4101904 IC50 = 64.4 nM 7.19
CHEMBL4060356 IC50 = 66.5 nM 7.18
CHEMBL4104307 IC50 = 77.8 nM 7.11
CHEMBL3952795 IC50 = 88.3 nM 7.05
CHEMBL4071161 TIRABRUTINIB IC50 = 103.0 nM 6.99
CHEMBL4079803 IC50 = 116.1 nM 6.93
CHEMBL4075845 IC50 = 121.1 nM 6.92
CHEMBL3707348 ACALABRUTINIB IC50 = 198.0 nM 6.70
CHEMBL4082268 IC50 = 240.9 nM 6.62
CHEMBL4075253 IC50 = 387.0 nM 6.41
CHEMBL4065122 FENEBRUTINIB IC70 = 27.0 nM -
CHEMBL4065122 FENEBRUTINIB IC90 = 135.0 nM -