Skip to main content
Free research Free research Free assay review with research home and workspace preview
Quick search ChEMBL 36
Assay Detail

CHEMBL4431786

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

Binding
Inhibition of recombinant Toxoplasma gondii CDPK1 using Biotin-C6-PLARTLSVAGLPGKK as substrate after 90 mins in presence of ATP by luciferase reporter gene assay
34
Total Activities
34
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

Development of an Orally Available and Central Nervous System (CNS) Penetrant Toxoplasma gondii Calcium-Dependent Protein Kinase 1 (TgCDPK1) Inhibitor with Minimal Human Ether-a-go-go-Related Gene (hERG) Activity for the Treatment of Toxoplasmosis.
Vidadala RS, Rivas KL, Ojo KK, Hulverson MA, Zambriski JA, Bruzual I, Schultz TL, Huang W, Zhang Z, Scheele S, DeRocher AE, Choi R, Barrett LK, Siddaramaiah LK, Hol WG, Fan E, Merritt EA, Parsons M, Freiberg G, Marsh K, Kempf DJ, Carruthers VB, Isoherranen N, Doggett JS, Van Voorhis WC, Maly DJ.
J Med Chem (2016) 59 : 6531 -6546
PubMed 27309760 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 34 8.43 9.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4591429 1 9.10
CHEMBL4553699 1 9.05
CHEMBL4571877 1 9.00
CHEMBL4455656 1 8.96
CHEMBL4558168 1 8.92
CHEMBL4471923 1 8.89
CHEMBL4543259 1 8.82
CHEMBL4517731 1 8.80
CHEMBL4476674 1 8.74
CHEMBL4556402 1 8.74
CHEMBL4536241 1 8.70
CHEMBL4573817 1 8.70
CHEMBL4537636 1 8.70
CHEMBL4439120 1 8.68
CHEMBL4450160 1 8.66
CHEMBL4572244 1 8.62
CHEMBL4444685 1 8.60
CHEMBL2078876 1 8.54
CHEMBL4587540 1 8.49
CHEMBL4445333 1 8.48
CHEMBL4572930 1 8.40
CHEMBL4582694 1 8.40
CHEMBL4443394 1 8.35
CHEMBL4461001 1 8.25
CHEMBL4558606 1 8.22
CHEMBL4576165 1 8.21
CHEMBL4435505 1 8.00
CHEMBL4445679 1 8.00
CHEMBL2078877 1 7.96
CHEMBL4469755 1 7.82

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4591429 IC50 = 0.8 nM 9.10
CHEMBL4553699 IC50 = 0.9 nM 9.05
CHEMBL4571877 IC50 = 1.0 nM 9.00
CHEMBL4455656 IC50 = 1.1 nM 8.96
CHEMBL4558168 IC50 = 1.2 nM 8.92
CHEMBL4471923 IC50 = 1.3 nM 8.89
CHEMBL4543259 IC50 = 1.5 nM 8.82
CHEMBL4517731 IC50 = 1.6 nM 8.80
CHEMBL4476674 IC50 = 1.8 nM 8.74
CHEMBL4556402 IC50 = 1.8 nM 8.74
CHEMBL4536241 IC50 = 2.0 nM 8.70
CHEMBL4573817 IC50 = 2.0 nM 8.70
CHEMBL4537636 IC50 = 2.0 nM 8.70
CHEMBL4439120 IC50 = 2.1 nM 8.68
CHEMBL4450160 IC50 = 2.2 nM 8.66
CHEMBL4572244 IC50 = 2.4 nM 8.62
CHEMBL4444685 IC50 = 2.5 nM 8.60
CHEMBL2078876 IC50 = 2.9 nM 8.54
CHEMBL4587540 IC50 = 3.2 nM 8.49
CHEMBL4445333 IC50 = 3.3 nM 8.48
CHEMBL4572930 IC50 = 4.0 nM 8.40
CHEMBL4582694 IC50 = 4.0 nM 8.40
CHEMBL4443394 IC50 = 4.5 nM 8.35
CHEMBL4461001 IC50 = 5.6 nM 8.25
CHEMBL4558606 IC50 = 6.0 nM 8.22
CHEMBL4576165 IC50 = 6.1 nM 8.21
CHEMBL4435505 IC50 = 10.0 nM 8.00
CHEMBL4445679 IC50 = 10.0 nM 8.00
CHEMBL2078877 IC50 = 11.0 nM 7.96
CHEMBL4469755 IC50 = 15.0 nM 7.82
CHEMBL4440560 IC50 = 17.0 nM 7.77
CHEMBL4593860 IC50 = 24.0 nM 7.62
CHEMBL4464073 IC50 = 46.0 nM 7.34
CHEMBL4584646 IC50 = 94.0 nM 7.03