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Assay Detail

CHEMBL4818907

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

Binding
Covalent inhibition of recombinant human GST-tagged BTK (2 to 659 end residues) expressed in baculovirus expression system assessed as inhibition constant using NH2-KKKAPFSWYLPEEG as substrate measured every 2 mins for 2 hrs in presence of ATP by microplate reader assay
16
Total Activities
15
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 a Potent and Selective Covalent Inhibitor of Bruton's Tyrosine Kinase with Oral Anti-Inflammatory Activity.
Tichenor MS, Wiener JJM, Rao NL, Pooley Deckhut C, Barbay JK, Kreutter KD, Bacani GM, Wei J, Chang L, Murrey HE, Wang W, Ahn K, Huber M, Rex E, Coe KJ, Wu J, Seierstad M, Bembenek SD, Leonard KA, Lebsack AD, Venable JD, Edwards JP.
ACS Med Chem Lett (2021) 12 : 782 -790
PubMed 34055226 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 16 6.83 8.32

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4853403 2 8.32
CHEMBL4854911 1 8.04
CHEMBL4846828 1 7.93
CHEMBL4875401 1 7.91
CHEMBL4849068 1 7.83
CHEMBL4851021 1 7.54
CHEMBL4852459 1 7.29
CHEMBL4861899 1 6.85
CHEMBL4871745 1 6.66
CHEMBL4871385 1 6.47
CHEMBL4877611 1 5.80
CHEMBL4863521 1 5.73
CHEMBL4877368 1 5.48
CHEMBL4853953 1 5.38
CHEMBL4873622 1 5.19

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4853403 Ki = 4.81 nM 8.32
CHEMBL4854911 Ki = 9.2 nM 8.04
CHEMBL4846828 Ki = 11.7 nM 7.93
CHEMBL4875401 Ki = 12.3 nM 7.91
CHEMBL4849068 Ki = 14.8 nM 7.83
CHEMBL4851021 Ki = 28.8 nM 7.54
CHEMBL4852459 Ki = 51.9 nM 7.29
CHEMBL4861899 Ki = 141.0 nM 6.85
CHEMBL4853403 Ki = 150.0 nM 6.82
CHEMBL4871745 Ki = 217.0 nM 6.66
CHEMBL4871385 Ki = 337.0 nM 6.47
CHEMBL4877611 Ki = 1580.0 nM 5.80
CHEMBL4863521 Ki = 1850.0 nM 5.73
CHEMBL4877368 Ki = 3290.0 nM 5.48
CHEMBL4853953 Ki = 4220.0 nM 5.38
CHEMBL4873622 Ki = 6420.0 nM 5.19