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Assay Detail

CHEMBL884433

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

Binding
Inhibitory concentration against dihydrofolate reductace enzyme of Pneumocystis carinii
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Pneumocystis carinii
Confidence 9 — Direct single protein target
Curated By Intermediate

Target

Dihydrofolate reductase (CHEMBL1926)
Type SINGLE PROTEIN
Organism Pneumocystis carinii

Publication

New 2,4-diamino-5-(2',5'-substituted benzyl)pyrimidines as potential drugs against opportunistic infections of AIDS and other immune disorders. Synthesis and species-dependent antifolate activity.
Rosowsky A, Forsch RA, Sibley CH, Inderlied CB, Queener SF.
J Med Chem (2004) 47 : 1475 -1486
PubMed 14998335 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 14 5.87 7.89

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL7492 PIRITREXIM 2.0 1 7.89
CHEMBL35020 1 7.64
CHEMBL288350 1 6.28
CHEMBL288647 1 6.05
CHEMBL284839 1 5.96
CHEMBL290806 1 5.92
CHEMBL34293 1 5.89
CHEMBL35437 1 5.64
CHEMBL34378 1 5.39
CHEMBL35080 1 5.25
CHEMBL38158 1 5.15
CHEMBL289908 1 5.11
CHEMBL34641 1 5.07
CHEMBL22 TRIMETHOPRIM 4.0 1 4.92

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL7492 PIRITREXIM IC50 = 13.0 nM 7.89
CHEMBL35020 IC50 = 23.0 nM 7.64
CHEMBL288350 IC50 = 530.0 nM 6.28
CHEMBL288647 IC50 = 890.0 nM 6.05
CHEMBL284839 IC50 = 1100.0 nM 5.96
CHEMBL290806 IC50 = 1200.0 nM 5.92
CHEMBL34293 IC50 = 1300.0 nM 5.89
CHEMBL35437 IC50 = 2300.0 nM 5.64
CHEMBL34378 IC50 = 4100.0 nM 5.39
CHEMBL35080 IC50 = 5600.0 nM 5.25
CHEMBL38158 IC50 = 7100.0 nM 5.15
CHEMBL289908 IC50 = 7800.0 nM 5.11
CHEMBL34641 IC50 = 8600.0 nM 5.07
CHEMBL22 TRIMETHOPRIM IC50 = 12000.0 nM 4.92