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Assay Detail

CHEMBL3788092

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

Binding
Inhibition of human recombinant dihydrofolate reductase using dihydrofolate as substrate measured every 30 secs over 6 mins by UV/visible spectrophotometer in presence of NADPH
8
Total Activities
8
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Dihydrofolate reductase (CHEMBL202)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Applying the designed multiple ligands approach to inhibit dihydrofolate reductase and thioredoxin reductase for anti-proliferative activity.
Ng HL, Chen S, Chew EH, Chui WK.
Eur J Med Chem (2016) 115 : 63 -74
PubMed 26994844 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 8 5.87 8.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL34259 METHOTREXATE 4.0 1 8.10
CHEMBL1824770 1 6.37
CHEMBL3787397 1 5.62
CHEMBL532909 1 5.03
CHEMBL3785981 1 4.25
CHEMBL7976 CHALCONE 1 -
CHEMBL3785320 1 -
CHEMBL3787681 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL34259 METHOTREXATE IC50 = 7.9 nM 8.10
CHEMBL1824770 IC50 = 430.0 nM 6.37
CHEMBL3787397 IC50 = 2400.0 nM 5.62
CHEMBL532909 IC50 = 9400.0 nM 5.03
CHEMBL3785981 IC50 = 56400.0 nM 4.25
CHEMBL7976 CHALCONE IC50 > 100000.0 nM -
CHEMBL3785320 IC50 > 100000.0 nM -
CHEMBL3787681 IC50 > 100000.0 nM -