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Assay Detail

CHEMBL4701067

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Binding
Inhibition of recombinant human full-length N-terminal His6-tagged BTK expressed in baculovirus infected Sf21 insect cells using fluorescein-labeled polyGAT peptide substrate measured after 30 mins by TR-FRET assay
22
Total Activities
22
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type Sf21
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

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

Publication

Discovery of BIIB068: A Selective, Potent, Reversible Bruton's Tyrosine Kinase Inhibitor as an Orally Efficacious Agent for Autoimmune Diseases.
Ma B,Bohnert T,Otipoby KL,Tien E,Arefayene M,Bai J,Bajrami B,Bame E,Chan TR,Humora M,MacPhee JM,Marcotte D,Mehta D,Metrick CM,Moniz G,Polack E,Poreci U,Prefontaine A,Sheikh S,Schroeder P,Smirnakis K,Zhang L,Zheng F,Hopkins BT
J Med Chem (2020) 63 : 12526 -12541
PubMed 32696648 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 22 8.16 9.70

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4782313 1 9.70
CHEMBL4754065 1 9.70
CHEMBL4796367 1 9.40
CHEMBL4746275 1 9.40
CHEMBL4744041 1 9.00
CHEMBL4797536 1 8.77
CHEMBL4788285 1 8.74
CHEMBL4760128 1 8.70
CHEMBL4749757 1 8.70
CHEMBL4792826 1 8.68
CHEMBL4740150 1 8.52
CHEMBL4756023 1 8.30
CHEMBL4783488 1 8.22
CHEMBL4764045 1 8.05
CHEMBL4753530 1 8.00
CHEMBL4763987 1 7.82
CHEMBL4791140 1 7.50
CHEMBL4741954 1 7.40
CHEMBL4778259 1 7.03
CHEMBL4755663 1 6.85
CHEMBL4757354 1 5.50
CHEMBL4789778 1 5.43

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4782313 IC50 = 0.2 nM 9.70
CHEMBL4754065 IC50 = 0.2 nM 9.70
CHEMBL4796367 IC50 = 0.4 nM 9.40
CHEMBL4746275 IC50 = 0.4 nM 9.40
CHEMBL4744041 IC50 = 1.0 nM 9.00
CHEMBL4797536 IC50 = 1.7 nM 8.77
CHEMBL4788285 IC50 = 1.8 nM 8.74
CHEMBL4760128 IC50 = 2.0 nM 8.70
CHEMBL4749757 IC50 = 2.0 nM 8.70
CHEMBL4792826 IC50 = 2.1 nM 8.68
CHEMBL4740150 IC50 = 3.0 nM 8.52
CHEMBL4756023 IC50 = 5.0 nM 8.30
CHEMBL4783488 IC50 = 6.0 nM 8.22
CHEMBL4764045 IC50 = 9.0 nM 8.05
CHEMBL4753530 IC50 = 10.0 nM 8.00
CHEMBL4763987 IC50 = 15.0 nM 7.82
CHEMBL4791140 IC50 = 32.0 nM 7.50
CHEMBL4741954 IC50 = 40.0 nM 7.40
CHEMBL4778259 IC50 = 94.0 nM 7.03
CHEMBL4755663 IC50 = 142.0 nM 6.85
CHEMBL4757354 IC50 = 3200.0 nM 5.50
CHEMBL4789778 IC50 = 3700.0 nM 5.43