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Assay Detail

CHEMBL5040109

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

Binding
Inhibition of recombinant human LRRK2 WT using fluorescein-labeled LRRKtide as substrate in presence of ATP preincubated for 50 mins followed by anti-phospho-LRRKtide antibody addition and measured after 30 mins by TR-FRET based Lanthascreen kinase activity assay
32
Total Activities
31
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

Publication

Design and Synthesis of Pyrrolo[2,3-<i>d</i>]pyrimidine-Derived Leucine-Rich Repeat Kinase 2 (LRRK2) Inhibitors Using a Checkpoint Kinase 1 (CHK1)-Derived Crystallographic Surrogate.
Williamson DS, Smith GP, Mikkelsen GK, Jensen T, Acheson-Dossang P, Badolo L, Bedford ST, Chell V, Chen IJ, Dokurno P, Hentzer M, Newland S, Ray SC, Shaw T, Surgenor AE, Terry L, Wang Y, Christensen KV.
J Med Chem (2021) 64 : 10312 -10332
PubMed 34184879 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 32 6.79 8.22

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5075978 1 8.22
CHEMBL5091909 1 8.22
CHEMBL5086513 1 7.82
CHEMBL5086506 1 7.80
CHEMBL5089152 2 7.72
CHEMBL5087055 1 7.70
CHEMBL5092087 1 7.64
CHEMBL5080937 1 7.47
CHEMBL5090953 1 7.47
CHEMBL5075824 1 7.42
CHEMBL5083563 1 7.42
CHEMBL5073900 1 7.38
CHEMBL5088551 1 7.37
CHEMBL5078540 1 7.33
CHEMBL5091819 1 7.31
CHEMBL5094228 1 7.24
CHEMBL5089194 1 7.12
CHEMBL5078779 1 6.78
CHEMBL5073457 1 6.63
CHEMBL5089834 1 6.61
CHEMBL5074790 1 6.29
CHEMBL5093192 1 6.24
CHEMBL5092519 1 5.90
CHEMBL5083940 1 5.83
CHEMBL5070699 1 5.68
CHEMBL5080604 1 5.50
CHEMBL5091544 1 5.33
CHEMBL5083394 1 5.25
CHEMBL5093047 1 5.22
CHEMBL5091290 1 5.17

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5075978 IC50 = 6.0 nM 8.22
CHEMBL5091909 IC50 = 6.0 nM 8.22
CHEMBL5086513 IC50 = 15.0 nM 7.82
CHEMBL5086506 IC50 = 16.0 nM 7.80
CHEMBL5089152 IC50 = 19.0 nM 7.72
CHEMBL5087055 IC50 = 20.0 nM 7.70
CHEMBL5092087 IC50 = 23.0 nM 7.64
CHEMBL5090953 IC50 = 34.0 nM 7.47
CHEMBL5080937 IC50 = 34.0 nM 7.47
CHEMBL5075824 IC50 = 38.0 nM 7.42
CHEMBL5083563 IC50 = 38.0 nM 7.42
CHEMBL5073900 IC50 = 42.0 nM 7.38
CHEMBL5088551 IC50 = 43.0 nM 7.37
CHEMBL5089152 IC50 = 44.0 nM 7.36
CHEMBL5078540 IC50 = 47.0 nM 7.33
CHEMBL5091819 IC50 = 49.0 nM 7.31
CHEMBL5094228 IC50 = 57.0 nM 7.24
CHEMBL5089194 IC50 = 75.0 nM 7.12
CHEMBL5078779 IC50 = 166.0 nM 6.78
CHEMBL5073457 IC50 = 234.0 nM 6.63
CHEMBL5089834 IC50 = 248.0 nM 6.61
CHEMBL5074790 IC50 = 508.0 nM 6.29
CHEMBL5093192 IC50 = 572.0 nM 6.24
CHEMBL5092519 IC50 = 1258.0 nM 5.90
CHEMBL5083940 IC50 = 1484.0 nM 5.83
CHEMBL5070699 IC50 = 2109.0 nM 5.68
CHEMBL5080604 IC50 = 3192.0 nM 5.50
CHEMBL5091544 IC50 = 4619.0 nM 5.33
CHEMBL5083394 IC50 = 5663.0 nM 5.25
CHEMBL5093047 IC50 = 6055.0 nM 5.22
CHEMBL5091290 IC50 = 6832.0 nM 5.17
CHEMBL5089345 IC50 = 14381.0 nM 4.84