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Assay Detail

CHEMBL5166478

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

Binding
Displacement of [3H]NCS-382 from CaMK2alpha in rat brain cerebral cortex membrane homogenates assessed as inhibition constant measured after 60 mins by TopCount scintillation counting method
38
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Rattus norvegicus
Tissue Cerebral cortex
Subcellular Membrane
Confidence 9 — Direct single protein target
Curated By Autocuration

Publication

Discovery and Optimization of 5-Hydroxy-Diclofenac toward a New Class of Ligands with Nanomolar Affinity for the CaMKIIα Hub Domain.
Tian Y, Shehata MA, Gauger SJ, Ng CKL, Solbak S, Thiesen L, Bruus-Jensen J, Krall J, Bundgaard C, Gibson KM, Wellendorph P, Frølund B.
J Med Chem (2022) 65 : 6656 -6676
PubMed 35500061 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 38 6.59 7.85

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5206854 2 7.85
CHEMBL5191835 2 7.60
CHEMBL5196669 2 7.51
CHEMBL5178954 2 7.50
CHEMBL5175277 1 7.46
CHEMBL5181927 2 7.33
CHEMBL5172225 2 7.20
CHEMBL5198167 2 7.20
CHEMBL5200347 2 7.13
CHEMBL5181512 2 7.11
CHEMBL5190371 2 6.40
CHEMBL5194429 2 6.30
CHEMBL5192513 2 6.10
CHEMBL1031 5-HYDROXY-DICLOFENAC 2 6.10
CHEMBL5192904 2 5.92
CHEMBL5181959 2 5.92
CHEMBL139 DICLOFENAC 4.0 1 5.29
CHEMBL5182248 2 4.70
CHEMBL5207563 2 4.70
CHEMBL5181640 1 -
CHEMBL5203615 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5206854 Ki = 14.0 nM 7.85
CHEMBL5206854 Ki = 15.85 nM 7.80
CHEMBL5191835 Ki = 25.12 nM 7.60
CHEMBL5191835 Ki = 27.0 nM 7.57
CHEMBL5196669 Ki = 31.0 nM 7.51
CHEMBL5196669 Ki = 31.62 nM 7.50
CHEMBL5178954 Ki = 31.62 nM 7.50
CHEMBL5178954 Ki = 33.0 nM 7.48
CHEMBL5175277 Ki = 35.0 nM 7.46
CHEMBL5181927 Ki = 47.0 nM 7.33
CHEMBL5181927 Ki = 50.12 nM 7.30
CHEMBL5198167 Ki = 63.1 nM 7.20
CHEMBL5172225 Ki = 63.1 nM 7.20
CHEMBL5172225 Ki = 70.0 nM 7.16
CHEMBL5198167 Ki = 70.0 nM 7.16
CHEMBL5200347 Ki = 74.0 nM 7.13
CHEMBL5181512 Ki = 77.0 nM 7.11
CHEMBL5200347 Ki = 79.43 nM 7.10
CHEMBL5181512 Ki = 79.43 nM 7.10
CHEMBL5190371 Ki = 398.11 nM 6.40
CHEMBL5190371 Ki = 420.0 nM 6.38
CHEMBL5194429 Ki = 500.0 nM 6.30
CHEMBL5194429 Ki = 501.19 nM 6.30
CHEMBL5192513 Ki = 794.33 nM 6.10
CHEMBL1031 5-HYDROXY-DICLOFENAC Ki = 794.33 nM 6.10
CHEMBL5192513 Ki = 830.0 nM 6.08
CHEMBL1031 5-HYDROXY-DICLOFENAC Ki = 900.0 nM 6.05
CHEMBL5181959 Ki = 1200.0 nM 5.92
CHEMBL5192904 Ki = 1200.0 nM 5.92
CHEMBL5192904 Ki = 1258.93 nM 5.90
CHEMBL5181959 Ki = 1258.93 nM 5.90
CHEMBL139 DICLOFENAC Ki = 5100.0 nM 5.29
CHEMBL5207563 Ki = 20000.0 nM 4.70
CHEMBL5182248 Ki = 19952.62 nM 4.70
CHEMBL5207563 Ki = 19952.62 nM 4.70
CHEMBL5182248 Ki = 25000.0 nM 4.60
CHEMBL5203615 Ki > 100000.0 nM -
CHEMBL5181640 Ki > 100000.0 nM -