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Assay Detail

CHEMBL4416170

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

Binding
Inhibition of Plasmodium falciparum full length N-terminal His-tagged PKG expressed in Escherichia coli RosettaTM 2(DE3) pLysS cells using FAM-GRTGRRNSI-NH2 as substrate preincubated for 30 mins followed by ATP addition and measured after 30 mins by microfluidic mobility shift assay
57
Total Activities
57
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Plasmodium falciparum
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

cGMP-dependent protein kinase (CHEMBL2169724)
Type SINGLE PROTEIN
Organism Plasmodium falciparum

Publication

Development of Chemical Entities Endowed with Potent Fast-Killing Properties against <i>Plasmodium falciparum</i> Malaria Parasites.
Matralis AN, Malik A, Penzo M, Moreno I, Almela MJ, Camino I, Crespo B, Saadeddin A, Ghidelli-Disse S, Rueda L, Calderon F, Osborne SA, Drewes G, Böesche M, Fernández-Álvaro E, Martin Hernando JI, Baker DA.
J Med Chem (2019) 62 : 9217 -9235
PubMed 31566384 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 57 8.16 9.22

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4531058 1 9.22
CHEMBL4459320 1 8.89
CHEMBL4469667 1 8.77
CHEMBL4532321 1 8.77
CHEMBL4449947 1 8.77
CHEMBL4451783 1 8.77
CHEMBL4461276 1 8.77
CHEMBL4288103 1 8.70
CHEMBL4455587 1 8.70
CHEMBL4286841 1 8.70
CHEMBL4593717 1 8.64
CHEMBL4572858 1 8.52
CHEMBL4585607 1 8.48
CHEMBL4531226 1 8.44
CHEMBL4444451 1 8.44
CHEMBL4566588 1 8.42
CHEMBL4546641 1 8.37
CHEMBL4591417 1 8.36
CHEMBL4459919 1 8.32
CHEMBL4446015 1 8.30
CHEMBL4446024 1 8.25
CHEMBL4473609 1 8.00
CHEMBL4585479 1 7.99
CHEMBL4572065 1 7.93
CHEMBL4461850 1 7.90
CHEMBL4462111 1 7.79
CHEMBL4567664 1 7.47
CHEMBL4572752 1 7.35
CHEMBL4548154 1 7.28
CHEMBL4516715 1 7.05

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4531058 IC50 = 0.6 nM 9.22
CHEMBL4459320 IC50 = 1.3 nM 8.89
CHEMBL4532321 IC50 = 1.7 nM 8.77
CHEMBL4449947 IC50 = 1.7 nM 8.77
CHEMBL4451783 IC50 = 1.7 nM 8.77
CHEMBL4461276 IC50 = 1.7 nM 8.77
CHEMBL4469667 IC50 = 1.7 nM 8.77
CHEMBL4288103 IC50 = 2.0 nM 8.70
CHEMBL4455587 IC50 = 2.0 nM 8.70
CHEMBL4286841 IC50 = 2.0 nM 8.70
CHEMBL4593717 IC50 = 2.3 nM 8.64
CHEMBL4572858 IC50 = 3.0 nM 8.52
CHEMBL4585607 IC50 = 3.3 nM 8.48
CHEMBL4444451 IC50 = 3.6 nM 8.44
CHEMBL4531226 IC50 = 3.6 nM 8.44
CHEMBL4566588 IC50 = 3.8 nM 8.42
CHEMBL4546641 IC50 = 4.3 nM 8.37
CHEMBL4591417 IC50 = 4.4 nM 8.36
CHEMBL4459919 IC50 = 4.8 nM 8.32
CHEMBL4446015 IC50 = 5.0 nM 8.30
CHEMBL4446024 IC50 = 5.6 nM 8.25
CHEMBL4473609 IC50 = 10.0 nM 8.00
CHEMBL4585479 IC50 = 10.2 nM 7.99
CHEMBL4572065 IC50 = 11.7 nM 7.93
CHEMBL4461850 IC50 = 12.6 nM 7.90
CHEMBL4462111 IC50 = 16.2 nM 7.79
CHEMBL4567664 IC50 = 33.9 nM 7.47
CHEMBL4572752 IC50 = 44.7 nM 7.35
CHEMBL4548154 IC50 = 52.5 nM 7.28
CHEMBL4516715 IC50 = 89.1 nM 7.05
CHEMBL4444869 IC50 = 1259.0 nM 5.90
CHEMBL4551036 IC50 = 1862.0 nM 5.73
CHEMBL4586918 IC50 - -
CHEMBL4436765 IC50 - -
CHEMBL4586441 IC50 - -
CHEMBL4534387 IC50 - -
CHEMBL4454838 IC50 - -
CHEMBL4565096 IC50 - -
CHEMBL4439775 IC50 - -
CHEMBL4441206 IC50 - -
CHEMBL4566303 IC50 - -
CHEMBL4461043 IC50 - -
CHEMBL4453994 IC50 - -
CHEMBL4437350 IC50 - -
CHEMBL4536120 IC50 - -
CHEMBL4471859 IC50 - -
CHEMBL4465850 IC50 - -
CHEMBL4552534 IC50 - -
CHEMBL4530907 IC50 - -
CHEMBL4448543 IC50 - -