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Assay Detail

CHEMBL4622573

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

Binding
Inhibition of BTK in human whole blood assessed as reduction in autophosphorylation at Y223 residue incubated for 1 hr by mesoscale assay
28
Total Activities
28
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

Stereochemical Differences in Fluorocyclopropyl Amides Enable Tuning of Btk Inhibition and Off-Target Activity.
Crawford JJ, Lee W, Johnson AR, Delatorre KJ, Chen J, Eigenbrot C, Heidmann J, Kakiuchi-Kiyota S, Katewa A, Kiefer JR, Liu L, Lubach JW, Misner D, Purkey H, Reif K, Vogt J, Wong H, Yu C, Young WB.
ACS Med Chem Lett (2020) 11 : 1588 -1597
PubMed 32832028 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 28 7.71 8.72

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4638277 1 8.72
CHEMBL4643319 1 8.70
CHEMBL4065122 FENEBRUTINIB 3.0 1 8.64
CHEMBL4644207 1 8.64
CHEMBL4634904 1 8.62
CHEMBL4648439 1 8.49
CHEMBL4644448 1 8.42
CHEMBL4641507 1 8.32
CHEMBL4646964 1 8.29
CHEMBL4644856 1 8.15
CHEMBL4638307 1 8.14
CHEMBL4649410 1 8.11
CHEMBL4638562 1 7.92
CHEMBL4648782 1 7.85
CHEMBL4646782 1 7.82
CHEMBL4647342 1 7.66
CHEMBL4647569 1 7.58
CHEMBL4633058 1 7.50
CHEMBL4649614 1 7.36
CHEMBL4636316 1 7.22
CHEMBL4640083 1 7.13
CHEMBL4638921 1 7.13
CHEMBL4638609 1 7.01
CHEMBL4639728 1 6.70
CHEMBL4643339 1 6.55
CHEMBL4646580 1 6.50
CHEMBL4638802 1 6.44
CHEMBL4643297 1 6.39

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4638277 IC50 = 1.9 nM 8.72
CHEMBL4643319 IC50 = 2.0 nM 8.70
CHEMBL4065122 FENEBRUTINIB IC50 = 2.3 nM 8.64
CHEMBL4644207 IC50 = 2.3 nM 8.64
CHEMBL4634904 IC50 = 2.4 nM 8.62
CHEMBL4648439 IC50 = 3.2 nM 8.49
CHEMBL4644448 IC50 = 3.8 nM 8.42
CHEMBL4641507 IC50 = 4.8 nM 8.32
CHEMBL4646964 IC50 = 5.1 nM 8.29
CHEMBL4644856 IC50 = 7.1 nM 8.15
CHEMBL4638307 IC50 = 7.2 nM 8.14
CHEMBL4649410 IC50 = 7.7 nM 8.11
CHEMBL4638562 IC50 = 12.0 nM 7.92
CHEMBL4648782 IC50 = 14.0 nM 7.85
CHEMBL4646782 IC50 = 15.0 nM 7.82
CHEMBL4647342 IC50 = 22.0 nM 7.66
CHEMBL4647569 IC50 = 26.0 nM 7.58
CHEMBL4633058 IC50 = 32.0 nM 7.50
CHEMBL4649614 IC50 = 44.0 nM 7.36
CHEMBL4636316 IC50 = 60.0 nM 7.22
CHEMBL4640083 IC50 = 74.0 nM 7.13
CHEMBL4638921 IC50 = 74.0 nM 7.13
CHEMBL4638609 IC50 = 98.0 nM 7.01
CHEMBL4639728 IC50 = 200.0 nM 6.70
CHEMBL4643339 IC50 = 280.0 nM 6.55
CHEMBL4646580 IC50 = 320.0 nM 6.50
CHEMBL4638802 IC50 = 360.0 nM 6.44
CHEMBL4643297 IC50 = 410.0 nM 6.39