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Assay Detail

CHEMBL4610787

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

Binding
Inhibition of recombinant human His-tagged full length BTK expressed in baculovirus expression system using Ulight-Poly GT as substrate incubated for 2 hrs by Lanthascreen TR-FRET assay
23
Total Activities
23
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

Design and synthesis of boron-containing diphenylpyrimidines as potent BTK and JAK3 dual inhibitors.
Ren J, Shi W, Zhao D, Wang Q, Chang X, He X, Wang X, Gao Y, Lu P, Zhang X, Xu H, Zhang Y.
Bioorg Med Chem (2020) 28 : 115236 -115236
PubMed 31843459 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 23 8.17 9.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1873475 IBRUTINIB 4.0 1 9.52
CHEMBL4642642 1 9.22
CHEMBL4640647 1 8.82
CHEMBL4649397 1 8.77
CHEMBL4648104 1 8.72
CHEMBL4645290 1 8.70
CHEMBL4648837 1 8.54
CHEMBL4647555 1 8.33
CHEMBL4647822 1 8.21
CHEMBL4640192 1 8.19
CHEMBL4647100 1 8.19
CHEMBL4648257 1 8.09
CHEMBL4647623 1 8.07
CHEMBL3301625 SPEBRUTINIB 2.0 1 8.01
CHEMBL4640054 1 7.93
CHEMBL4633949 1 7.43
CHEMBL4635803 1 7.20
CHEMBL4639063 1 6.81
CHEMBL4639665 1 6.57
CHEMBL221959 TOFACITINIB 4.0 1 -
CHEMBL4647525 1 -
CHEMBL4649339 1 -
CHEMBL4637760 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1873475 IBRUTINIB IC50 = 0.3 nM 9.52
CHEMBL4642642 IC50 = 0.6 nM 9.22
CHEMBL4640647 IC50 = 1.5 nM 8.82
CHEMBL4649397 IC50 = 1.7 nM 8.77
CHEMBL4648104 IC50 = 1.9 nM 8.72
CHEMBL4645290 IC50 = 2.0 nM 8.70
CHEMBL4648837 IC50 = 2.9 nM 8.54
CHEMBL4647555 IC50 = 4.7 nM 8.33
CHEMBL4647822 IC50 = 6.1 nM 8.21
CHEMBL4640192 IC50 = 6.5 nM 8.19
CHEMBL4647100 IC50 = 6.5 nM 8.19
CHEMBL4648257 IC50 = 8.2 nM 8.09
CHEMBL4647623 IC50 = 8.5 nM 8.07
CHEMBL3301625 SPEBRUTINIB IC50 = 9.8 nM 8.01
CHEMBL4640054 IC50 = 11.8 nM 7.93
CHEMBL4633949 IC50 = 36.8 nM 7.43
CHEMBL4635803 IC50 = 63.0 nM 7.20
CHEMBL4639063 IC50 = 156.2 nM 6.81
CHEMBL4639665 IC50 = 267.8 nM 6.57
CHEMBL221959 TOFACITINIB IC50 > 100.0 nM -
CHEMBL4647525 IC50 > 1000.0 nM -
CHEMBL4649339 IC50 > 1000.0 nM -
CHEMBL4637760 IC50 > 1000.0 nM -