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Assay Detail

CHEMBL815669

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Binding
Concentration required to inhibit 50% activity of Thymidylate synthase was determined
10
Total Activities
10
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

Thymidylate synthase (CHEMBL3160)
Type SINGLE PROTEIN
Organism Mus musculus

Publication

Quinazoline antifolate thymidylate synthase inhibitors: 2'-fluoro-N10-propargyl-5,8-dideazafolic acid and derivatives with modifications in the C2 position.
Jackman AL, Marsham PR, Thornton TJ, Bishop JA, O'Connor BM, Hughes LR, Calvert AH, Jones TR.
J Med Chem (1990) 33 : 3067 -3071
PubMed 2231607 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 10 7.36 8.05

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL104230 1 8.05
CHEMBL389051 1 7.70
CHEMBL169981 1 7.70
CHEMBL105026 1 7.44
CHEMBL434209 1 7.30
CHEMBL420280 1 7.24
CHEMBL104410 1 7.24
CHEMBL265098 1 7.17
CHEMBL321977 1 7.01
CHEMBL103059 1 6.77

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL104230 IC50 = 9.0 nM 8.05
CHEMBL389051 IC50 = 20.0 nM 7.70
CHEMBL169981 IC50 = 20.0 nM 7.70
CHEMBL105026 IC50 = 36.0 nM 7.44
CHEMBL434209 IC50 = 50.0 nM 7.30
CHEMBL420280 IC50 = 58.0 nM 7.24
CHEMBL104410 IC50 = 58.0 nM 7.24
CHEMBL265098 IC50 = 68.0 nM 7.17
CHEMBL321977 IC50 = 98.0 nM 7.01
CHEMBL103059 IC50 = 170.0 nM 6.77