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Assay Detail

CHEMBL5731494

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

Binding
Inhibition of ALK IR Anaplastic Lymphoma Kinase Activity: To measure the activity of the N2-(2-methoxyphenyl)pyrimidine derivative represented by formula 1 of the present invention to inhibit anaplastic lymphoma kinase (ALK) activity at enzyme level, the following experiment was performed by the same manner as described in experimental example 1 except that IR (Insulin Receptor) protein was used instead of ALK WT protein.
159
Total Activities
53
Compounds Tested
3
Activity Types
0
Assay Parameters

Assay Information

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

Target

Insulin receptor (CHEMBL1981)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

N2-(2-methoxyphenyl)pyrimidine derivative, method for preparing same, and pharmaceutical composition for cancer prevention or treatment containing same as active ingredient
(2018)

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 53 7.59 8.74
kon 53 - -
k_off 53 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4081656 3 8.74
CHEMBL4078406 3 8.72
CHEMBL5990800 3 8.68
CHEMBL5907234 3 8.64
CHEMBL4099660 3 8.64
CHEMBL4080869 3 8.59
CHEMBL4084168 3 8.59
CHEMBL4062466 3 8.49
CHEMBL5764344 3 8.46
CHEMBL4091928 3 8.46
CHEMBL4067503 3 8.42
CHEMBL4089672 3 8.41
CHEMBL4097392 3 8.32
CHEMBL4070217 3 8.24
CHEMBL4088751 3 8.22
CHEMBL4105099 3 8.22
CHEMBL4096452 3 8.21
CHEMBL5804159 3 8.00
CHEMBL5831597 3 8.00
CHEMBL5757765 3 8.00
CHEMBL6030742 3 8.00
CHEMBL5812517 3 8.00
CHEMBL5957476 3 8.00
CHEMBL4071105 3 7.77
CHEMBL4061549 3 7.75
CHEMBL5916115 3 7.70
CHEMBL5864674 3 7.70
CHEMBL5835139 3 7.70
CHEMBL6047646 3 7.70
CHEMBL6006760 3 7.70

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4081656 IC50 = 1.8 nM 8.74
CHEMBL4078406 IC50 = 1.9 nM 8.72
CHEMBL5990800 IC50 = 2.1 nM 8.68
CHEMBL4099660 IC50 = 2.3 nM 8.64
CHEMBL5907234 IC50 = 2.3 nM 8.64
CHEMBL4080869 IC50 = 2.6 nM 8.59
CHEMBL4084168 IC50 = 2.6 nM 8.59
CHEMBL4062466 IC50 = 3.2 nM 8.49
CHEMBL5764344 IC50 = 3.5 nM 8.46
CHEMBL4091928 IC50 = 3.5 nM 8.46
CHEMBL4067503 IC50 = 3.8 nM 8.42
CHEMBL4089672 IC50 = 3.9 nM 8.41
CHEMBL4097392 IC50 = 4.8 nM 8.32
CHEMBL4070217 IC50 = 5.7 nM 8.24
CHEMBL4088751 IC50 = 6.0 nM 8.22
CHEMBL4105099 IC50 = 6.0 nM 8.22
CHEMBL4096452 IC50 = 6.1 nM 8.21
CHEMBL5812517 IC50 = 10.0 nM 8.00
CHEMBL5757765 IC50 = 10.0 nM 8.00
CHEMBL5831597 IC50 = 10.0 nM 8.00
CHEMBL5957476 IC50 = 10.0 nM 8.00
CHEMBL5804159 IC50 = 10.0 nM 8.00
CHEMBL6030742 IC50 = 10.0 nM 8.00
CHEMBL4071105 IC50 = 17.0 nM 7.77
CHEMBL4061549 IC50 = 18.0 nM 7.75
CHEMBL5864674 IC50 = 20.0 nM 7.70
CHEMBL5835139 IC50 = 20.0 nM 7.70
CHEMBL6047646 IC50 = 20.0 nM 7.70
CHEMBL6006760 IC50 = 20.0 nM 7.70
CHEMBL5916115 IC50 = 20.0 nM 7.70
CHEMBL5742478 IC50 = 30.0 nM 7.52
CHEMBL5947897 IC50 = 30.0 nM 7.52
CHEMBL5751408 IC50 = 43.0 nM 7.37
CHEMBL5780443 IC50 = 50.0 nM 7.30
CHEMBL5983550 IC50 = 50.0 nM 7.30
CHEMBL5872198 IC50 = 57.0 nM 7.24
CHEMBL6052776 IC50 = 70.0 nM 7.16
CHEMBL5881889 IC50 = 80.0 nM 7.10
CHEMBL5748068 IC50 = 90.0 nM 7.05
CHEMBL5895722 IC50 = 100.0 nM 7.00
CHEMBL6014384 IC50 = 110.0 nM 6.96
CHEMBL5790566 IC50 = 120.0 nM 6.92
CHEMBL4089527 IC50 = 120.0 nM 6.92
CHEMBL5861896 IC50 = 140.0 nM 6.85
CHEMBL6011332 IC50 = 180.0 nM 6.75
CHEMBL5997057 IC50 = 380.0 nM 6.42
CHEMBL4061375 IC50 = 550.0 nM 6.26
CHEMBL5846140 IC50 = 630.0 nM 6.20
CHEMBL5773764 IC50 = 1100.0 nM 5.96
CHEMBL5775962 IC50 = 1700.0 nM 5.77