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Assay Detail

CHEMBL829522

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Binding
Inhibition of Escherichia coli thymidylate synthetase at 37 degree C pH 7.4
6
Total Activities
6
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

Thymidylate synthase (CHEMBL6137)
Type SINGLE PROTEIN
Organism Escherichia coli

Publication

Synthesis of classical, four-carbon bridged 5-substituted furo[2,3-d]pyrimidine and 6-substituted pyrrolo[2,3-d]pyrimidine analogues as antifolates.
Gangjee A, Zeng Y, McGuire JJ, Kisliuk RL.
J Med Chem (2005) 48 : 5329 -5336
PubMed 16078850 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 6 5.74 7.05

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL265510 1 7.05
CHEMBL225072 PEMETREXED 4.0 1 4.42
CHEMBL223279 1 -
CHEMBL192632 1 -
CHEMBL193275 1 -
CHEMBL365307 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL265510 IC50 = 90.0 nM 7.05
CHEMBL225072 PEMETREXED IC50 = 38000.0 nM 4.42
CHEMBL223279 IC50 > 180000.0 nM -
CHEMBL192632 IC50 > 180000.0 nM -
CHEMBL193275 IC50 > 100000.0 nM -
CHEMBL365307 IC50 > 170000.0 nM -