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Assay Detail

CHEMBL4407817

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

Binding
Inhibition of recombinant Escherichia coli IspC expressed in Escherichia coli M15 using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric assay
15
Total Activities
15
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

1-deoxy-D-xylulose 5-phosphate reductoisomerase (CHEMBL3421521)
Type SINGLE PROTEIN
Organism Escherichia coli

Publication

Novel reverse thia-analogs of fosmidomycin: Synthesis and antiplasmodial activity.
Lienau C, Gräwert T, Alves Avelar LA, Illarionov B, Held J, Knaab TC, Lungerich B, van Geelen L, Meier D, Geissler S, Cynis H, Riederer U, Buchholz M, Kalscheuer R, Bacher A, Mordmüller B, Fischer M, Kurz T.
Eur J Med Chem (2019) 181 : 111555 -111555
PubMed 31382119 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 15 5.81 7.89

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4567904 1 7.89
CHEMBL4590343 1 7.75
CHEMBL4474216 1 7.66
CHEMBL4592986 1 6.80
CHEMBL2164257 FOSMIDOMYCIN SODIUM 1 6.66
CHEMBL4447571 1 6.54
CHEMBL4544750 1 6.17
CHEMBL4462089 1 5.37
CHEMBL4437978 1 5.35
CHEMBL4564404 1 4.96
CHEMBL4572338 1 4.82
CHEMBL4452553 1 4.44
CHEMBL4545211 1 4.44
CHEMBL4578312 1 4.19
CHEMBL4458458 1 4.10

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4567904 IC50 = 13.0 nM 7.89
CHEMBL4590343 IC50 = 18.0 nM 7.75
CHEMBL4474216 IC50 = 22.0 nM 7.66
CHEMBL4592986 IC50 = 160.0 nM 6.80
CHEMBL2164257 FOSMIDOMYCIN SODIUM IC50 = 220.0 nM 6.66
CHEMBL4447571 IC50 = 290.0 nM 6.54
CHEMBL4544750 IC50 = 680.0 nM 6.17
CHEMBL4462089 IC50 = 4300.0 nM 5.37
CHEMBL4437978 IC50 = 4500.0 nM 5.35
CHEMBL4564404 IC50 = 11000.0 nM 4.96
CHEMBL4572338 IC50 = 15000.0 nM 4.82
CHEMBL4452553 IC50 = 36000.0 nM 4.44
CHEMBL4545211 IC50 = 36000.0 nM 4.44
CHEMBL4578312 IC50 = 64000.0 nM 4.19
CHEMBL4458458 IC50 = 80000.0 nM 4.10