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Assay Detail

CHEMBL665616

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Binding
Inhibitory activity against Toxoplasma gondii dihydrofolate reductase (in 90 uM dihydrofolic acid)
24
Total Activities
24
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-deaza-6-substituted pyrido[2,3-d]pyrimidine antifolates as potent and selective nonclassical inhibitors of dihydrofolate reductases.
Gangjee A, Vasudevan A, Queener SF, Kisliuk RL.
J Med Chem (1996) 39 : 1438 -1446
PubMed 8691474 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 24 6.63 8.20

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL32113 1 8.20
CHEMBL119 TRIMETREXATE 4.0 1 8.00
CHEMBL34259 METHOTREXATE 4.0 1 7.85
CHEMBL32190 1 7.85
CHEMBL36245 1 7.68
CHEMBL35222 1 7.58
CHEMBL33038 1 7.50
CHEMBL32583 1 6.71
CHEMBL32754 1 6.64
CHEMBL32708 1 6.51
CHEMBL33208 1 6.46
CHEMBL32220 1 6.42
CHEMBL280378 EPIROPRIM 2.0 1 6.33
CHEMBL284849 1 6.32
CHEMBL286700 1 6.28
CHEMBL35569 1 6.17
CHEMBL33357 1 6.15
CHEMBL32769 1 6.14
CHEMBL34337 1 6.04
CHEMBL32635 1 6.01
CHEMBL32266 1 5.92
CHEMBL22 TRIMETHOPRIM 4.0 1 5.57
CHEMBL33187 1 5.43
CHEMBL33136 1 5.35

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL32113 IC50 = 6.3 nM 8.20
CHEMBL119 TRIMETREXATE IC50 = 10.0 nM 8.00
CHEMBL34259 METHOTREXATE IC50 = 14.0 nM 7.85
CHEMBL32190 IC50 = 14.0 nM 7.85
CHEMBL36245 IC50 = 21.0 nM 7.68
CHEMBL35222 IC50 = 26.0 nM 7.58
CHEMBL33038 IC50 = 32.0 nM 7.50
CHEMBL32583 IC50 = 194.0 nM 6.71
CHEMBL32754 IC50 = 230.0 nM 6.64
CHEMBL32708 IC50 = 310.0 nM 6.51
CHEMBL33208 IC50 = 350.0 nM 6.46
CHEMBL32220 IC50 = 380.0 nM 6.42
CHEMBL280378 EPIROPRIM IC50 = 470.0 nM 6.33
CHEMBL284849 IC50 = 480.0 nM 6.32
CHEMBL286700 IC50 = 520.0 nM 6.28
CHEMBL35569 IC50 = 670.0 nM 6.17
CHEMBL33357 IC50 = 710.0 nM 6.15
CHEMBL32769 IC50 = 730.0 nM 6.14
CHEMBL34337 IC50 = 920.0 nM 6.04
CHEMBL32635 IC50 = 980.0 nM 6.01
CHEMBL32266 IC50 = 1200.0 nM 5.92
CHEMBL22 TRIMETHOPRIM IC50 = 2700.0 nM 5.57
CHEMBL33187 IC50 = 3700.0 nM 5.43
CHEMBL33136 IC50 = 4450.0 nM 5.35