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Assay Detail

CHEMBL665589

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

Binding
Inhibitory activity against Toxoplasma gondii Dihydrofolate reductase
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Bifunctional dihydrofolate reductase-thymidylate synthase (CHEMBL2425)
Type SINGLE PROTEIN
Organism Toxoplasma gondii

Publication

2,4-Diamino-5-substituted-quinazolines as inhibitors of a human dihydrofolate reductase with a site-directed mutation at position 22 and of the dihydrofolate reductases from Pneumocystis carinii and Toxoplasma gondii.
Rosowsky A, Mota CE, Queener SF, Waltham M, Ercikan-Abali E, Bertino JR.
J Med Chem (1995) 38 : 745 -752
PubMed 7877140 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 14 6.42 8.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL119 TRIMETREXATE 4.0 1 8.00
CHEMBL7492 PIRITREXIM 2.0 1 7.77
CHEMBL341703 1 6.43
CHEMBL36 PYRIMETHAMINE 4.0 1 6.41
CHEMBL441298 1 6.03
CHEMBL164845 1 5.92
CHEMBL22 TRIMETHOPRIM 4.0 1 5.57
CHEMBL349149 1 5.23
CHEMBL162312 1 -
CHEMBL434097 1 -
CHEMBL350730 1 -
CHEMBL162270 1 -
CHEMBL355151 1 -
CHEMBL165955 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL119 TRIMETREXATE IC50 = 10.0 nM 8.00
CHEMBL7492 PIRITREXIM IC50 = 17.0 nM 7.77
CHEMBL341703 IC50 = 370.0 nM 6.43
CHEMBL36 PYRIMETHAMINE IC50 = 390.0 nM 6.41
CHEMBL441298 IC50 = 930.0 nM 6.03
CHEMBL164845 IC50 = 1200.0 nM 5.92
CHEMBL22 TRIMETHOPRIM IC50 = 2700.0 nM 5.57
CHEMBL349149 IC50 = 5900.0 nM 5.23
CHEMBL162312 IC50 > 18000.0 nM -
CHEMBL434097 IC50 > 40000.0 nM -
CHEMBL350730 IC50 > 5000.0 nM -
CHEMBL162270 IC50 > 20000.0 nM -
CHEMBL355151 IC50 > 30000.0 nM -
CHEMBL165955 IC50 > 20000.0 nM -