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Assay Detail

CHEMBL3811380

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

Binding
Inhibition of wild type Myc-ectopic MPS1 (unknown origin) expressed in human HCT116 cells assessed as autophosphorylation at Thr33/Ser37 after 2 hrs by electrochemiluminescence assay in presence of MG132
16
Total Activities
16
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type HCT-116
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Dual specificity protein kinase TTK (CHEMBL3983)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Rapid Discovery of Pyrido[3,4-d]pyrimidine Inhibitors of Monopolar Spindle Kinase 1 (MPS1) Using a Structure-Based Hybridization Approach.
Innocenti P, Woodward HL, Solanki S, Naud S, Westwood IM, Cronin N, Hayes A, Roberts J, Henley AT, Baker R, Faisal A, Mak GW, Box G, Valenti M, De Haven Brandon A, O'Fee L, Saville H, Schmitt J, Matijssen B, Burke R, van Montfort RL, Raynaud FI, Eccles SA, Linardopoulos S, Blagg J, Hoelder S.
J Med Chem (2016) 59 : 3671 -3688
PubMed 27055065 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 16 6.18 7.37

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3109945 1 7.37
CHEMBL3809829 1 7.23
CHEMBL3809252 1 6.85
CHEMBL3809210 1 6.72
CHEMBL3808500 1 6.66
CHEMBL3809925 1 6.37
CHEMBL3809186 1 6.32
CHEMBL3809656 1 6.22
CHEMBL3809287 1 6.19
CHEMBL3809219 1 5.66
CHEMBL3808838 1 5.59
CHEMBL3808471 1 5.58
CHEMBL3809446 1 5.56
CHEMBL3810175 1 5.32
CHEMBL3808564 1 5.11
CHEMBL3809531 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3109945 IC50 = 43.0 nM 7.37
CHEMBL3809829 IC50 = 59.0 nM 7.23
CHEMBL3809252 IC50 = 140.0 nM 6.85
CHEMBL3809210 IC50 = 190.0 nM 6.72
CHEMBL3808500 IC50 = 220.0 nM 6.66
CHEMBL3809925 IC50 = 430.0 nM 6.37
CHEMBL3809186 IC50 = 480.0 nM 6.32
CHEMBL3809656 IC50 = 600.0 nM 6.22
CHEMBL3809287 IC50 = 650.0 nM 6.19
CHEMBL3809219 IC50 = 2200.0 nM 5.66
CHEMBL3808838 IC50 = 2540.0 nM 5.59
CHEMBL3808471 IC50 = 2640.0 nM 5.58
CHEMBL3809446 IC50 = 2770.0 nM 5.56
CHEMBL3810175 IC50 = 4840.0 nM 5.32
CHEMBL3808564 IC50 = 7810.0 nM 5.11
CHEMBL3809531 IC50 > 10000.0 nM -