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Assay Detail

CHEMBL665050

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Binding
Concentration inhibiting Pneumocystis carinii dihydrofolate reductase
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

2,4-Diaminopyrido[3,2-d]pyrimidine inhibitors of dihydrofolate reductase from Pneumocystis carinii and Toxoplasma gondii.
Rosowsky A, Forsch RA, Queener SF.
J Med Chem (1995) 38 : 2615 -2620
PubMed 7629801 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 14 7.03 7.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL328897 1 7.92
CHEMBL50514 1 7.89
CHEMBL300603 1 7.66
CHEMBL7492 PIRITREXIM 2.0 1 7.51
CHEMBL88555 1 7.48
CHEMBL119 TRIMETREXATE 4.0 1 7.38
CHEMBL88430 1 7.29
CHEMBL89528 1 7.21
CHEMBL23532 1 7.07
CHEMBL82975 1 7.00
CHEMBL52688 1 6.89
CHEMBL52947 1 5.85
CHEMBL54399 1 5.68
CHEMBL55179 1 5.58

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL328897 IC50 = 12.0 nM 7.92
CHEMBL50514 IC50 = 13.0 nM 7.89
CHEMBL300603 IC50 = 22.0 nM 7.66
CHEMBL7492 PIRITREXIM IC50 = 31.0 nM 7.51
CHEMBL88555 IC50 = 33.0 nM 7.48
CHEMBL119 TRIMETREXATE IC50 = 42.0 nM 7.38
CHEMBL88430 IC50 = 51.0 nM 7.29
CHEMBL89528 IC50 = 62.0 nM 7.21
CHEMBL23532 IC50 = 86.0 nM 7.07
CHEMBL82975 IC50 = 100.0 nM 7.00
CHEMBL52688 IC50 = 130.0 nM 6.89
CHEMBL52947 IC50 = 1400.0 nM 5.85
CHEMBL54399 IC50 = 2100.0 nM 5.68
CHEMBL55179 IC50 = 2600.0 nM 5.58