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Assay Detail

CHEMBL669249

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

Binding
Inhibitory activity against dihydrofolate reductase (DHFR) enzyme from Escherichia coli
9
Total Activities
9
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Escherichia coli
Confidence 9 — Direct single protein target
Curated By Intermediate

Target

Dihydrofolate reductase (CHEMBL1809)
Type SINGLE PROTEIN
Organism Escherichia coli

Publication

2,4-Diamino-5-benzylpyrimidines as antibacterial agents. 8. The 3,4,5-triethyl isostere of trimethoprim. A study of specificity.
Roth B, Aig E.
J Med Chem (1987) 30 : 1998 -2004
PubMed 3312605 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 9 6.89 8.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL22 TRIMETHOPRIM 4.0 1 8.30
CHEMBL57582 1 8.00
CHEMBL19633 DIAVERIDINE 2.0 1 7.30
CHEMBL293013 1 7.05
CHEMBL60883 1 6.55
CHEMBL59703 1 6.40
CHEMBL19023 1 6.30
CHEMBL60029 1 6.19
CHEMBL61287 1 5.96

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL22 TRIMETHOPRIM IC50 = 5.0 nM 8.30
CHEMBL57582 IC50 = 10.0 nM 8.00
CHEMBL19633 DIAVERIDINE IC50 = 50.0 nM 7.30
CHEMBL293013 IC50 = 90.0 nM 7.05
CHEMBL60883 IC50 = 280.0 nM 6.55
CHEMBL59703 IC50 = 400.0 nM 6.40
CHEMBL19023 IC50 = 500.0 nM 6.30
CHEMBL60029 IC50 = 650.0 nM 6.19
CHEMBL61287 IC50 = 1100.0 nM 5.96