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Assay Detail

CHEMBL4031136

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

Binding
Inhibition of C-terminal His-tagged full length Toxoplasma gondii CDPK1 expressed in Escherichia coli BL21 (DE3) using syntide-2 as substrate pre-incubated for 10 mins followed by ATP addition measured after 20 mins by ELISA
28
Total Activities
28
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Toxoplasma gondii
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Calmodulin-domain protein kinase 1 (CHEMBL1781862)
Type SINGLE PROTEIN
Organism Toxoplasma gondii

Publication

Inhibition of Calcium Dependent Protein Kinase 1 (CDPK1) by Pyrazolopyrimidine Analogs Decreases Establishment and Reoccurrence of Central Nervous System Disease by Toxoplasma gondii.
Rutaganira FU, Barks J, Dhason MS, Wang Q, Lopez MS, Long S, Radke JB, Jones NG, Maddirala AR, Janetka JW, El Bakkouri M, Hui R, Shokat KM, Sibley LD.
J Med Chem (2017) 60 : 9976 -9989
PubMed 28933846 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 28 7.48 8.47

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2324597 1 8.47
CHEMBL4102392 1 8.13
CHEMBL4078124 1 8.05
CHEMBL4087915 1 8.00
CHEMBL4098707 1 7.99
CHEMBL4086945 1 7.99
CHEMBL4069991 1 7.96
CHEMBL4094646 1 7.87
CHEMBL4074754 1 7.87
CHEMBL4065764 1 7.86
CHEMBL4093769 1 7.85
CHEMBL4096137 1 7.84
CHEMBL4098582 1 7.79
CHEMBL4090858 1 7.72
CHEMBL2324593 1 7.50
CHEMBL4097112 1 7.45
CHEMBL4065140 1 7.33
CHEMBL4088534 1 7.33
CHEMBL4095218 1 7.17
CHEMBL4060191 1 7.14
CHEMBL4090973 1 7.11
CHEMBL4080665 1 7.02
CHEMBL4073069 1 6.93
CHEMBL4080552 1 6.76
CHEMBL4067196 1 6.72
CHEMBL4068845 1 6.66
CHEMBL4088414 1 6.57
CHEMBL4069866 1 6.29

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2324597 IC50 = 3.38 nM 8.47
CHEMBL4102392 IC50 = 7.49 nM 8.13
CHEMBL4078124 IC50 = 8.94 nM 8.05
CHEMBL4087915 IC50 = 9.99 nM 8.00
CHEMBL4098707 IC50 = 10.2 nM 7.99
CHEMBL4086945 IC50 = 10.32 nM 7.99
CHEMBL4069991 IC50 = 10.9 nM 7.96
CHEMBL4094646 IC50 = 13.56 nM 7.87
CHEMBL4074754 IC50 = 13.53 nM 7.87
CHEMBL4065764 IC50 = 13.79 nM 7.86
CHEMBL4093769 IC50 = 14.15 nM 7.85
CHEMBL4096137 IC50 = 14.53 nM 7.84
CHEMBL4098582 IC50 = 16.4 nM 7.79
CHEMBL4090858 IC50 = 19.2 nM 7.72
CHEMBL2324593 IC50 = 31.86 nM 7.50
CHEMBL4097112 IC50 = 35.12 nM 7.45
CHEMBL4065140 IC50 = 46.98 nM 7.33
CHEMBL4088534 IC50 = 47.0 nM 7.33
CHEMBL4095218 IC50 = 67.5 nM 7.17
CHEMBL4060191 IC50 = 73.09 nM 7.14
CHEMBL4090973 IC50 = 77.5 nM 7.11
CHEMBL4080665 IC50 = 95.3 nM 7.02
CHEMBL4073069 IC50 = 118.6 nM 6.93
CHEMBL4080552 IC50 = 173.0 nM 6.76
CHEMBL4067196 IC50 = 190.6 nM 6.72
CHEMBL4068845 IC50 = 218.5 nM 6.66
CHEMBL4088414 IC50 = 271.9 nM 6.57
CHEMBL4069866 IC50 = 517.0 nM 6.29