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Assay Detail

CHEMBL911102

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Binding
Inhibition of recombinant Plasmodium falciparum DHODH
28
Total Activities
15
Compounds Tested
3
Activity Types
0
Assay Parameters

Assay Information

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

Target

Dihydroorotate dehydrogenase (CHEMBL3486)
Type SINGLE PROTEIN
Organism Plasmodium falciparum

Publication

Design and synthesis of potent inhibitors of the malaria parasite dihydroorotate dehydrogenase.
Heikkilä T, Ramsey C, Davies M, Galtier C, Stead AM, Johnson AP, Fishwick CW, Boa AN, McConkey GA.
J Med Chem (2007) 50 : 186 -191
PubMed 17228860 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 13 5.53 6.80
Ki 13 6.19 8.61
Km 2 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL387254 2 8.61
CHEMBL218467 2 7.70
CHEMBL217951 2 7.70
CHEMBL217893 2 7.52
CHEMBL218703 2 7.30
CHEMBL435137 2 5.50
CHEMBL219856 2 5.34
CHEMBL217897 2 5.00
CHEMBL973 TERIFLUNOMIDE 4.0 2 4.63
CHEMBL219855 2 4.40
CHEMBL413583 2 4.40
CHEMBL373493 2 -
CHEMBL374338 2 -
CHEMBL75782 DIHYDROOROTATE 1 -
CHEMBL217894 DECYLUBIQUINONE 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL387254 Ki = 2.45 nM 8.61
CHEMBL218467 Ki = 20.0 nM 7.70
CHEMBL217951 Ki = 20.0 nM 7.70
CHEMBL217893 Ki = 30.0 nM 7.52
CHEMBL218703 Ki = 50.0 nM 7.30
CHEMBL218467 IC50 = 160.0 nM 6.80
CHEMBL217951 IC50 = 180.0 nM 6.75
CHEMBL217893 IC50 = 230.0 nM 6.64
CHEMBL218703 IC50 = 440.0 nM 6.36
CHEMBL435137 Ki = 3200.0 nM 5.50
CHEMBL219856 Ki = 4600.0 nM 5.34
CHEMBL217897 Ki = 10000.0 nM 5.00
CHEMBL387254 IC50 = 21300.0 nM 4.67
CHEMBL973 TERIFLUNOMIDE Ki = 23350.0 nM 4.63
CHEMBL435137 IC50 = 27780.0 nM 4.56
CHEMBL219855 Ki = 40200.0 nM 4.40
CHEMBL413583 Ki = 39700.0 nM 4.40
CHEMBL219856 IC50 = 40000.0 nM 4.40
CHEMBL217897 IC50 = 86700.0 nM 4.06
CHEMBL373493 Ki - -
CHEMBL217894 DECYLUBIQUINONE Km = 13.4 -
CHEMBL374338 Ki - -
CHEMBL75782 DIHYDROOROTATE Km = 31.4 -
CHEMBL413583 IC50 = 345600.0 nM -
CHEMBL219855 IC50 = 349100.0 nM -
CHEMBL374338 IC50 > 500000.0 nM -
CHEMBL373493 IC50 > 500000.0 nM -
CHEMBL973 TERIFLUNOMIDE IC50 = 190100.0 nM -