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Assay Detail

CHEMBL2434045

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Binding
Inhibition of Escherichia coli IspC by photometric assay
25
Total Activities
25
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Escherichia coli
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

IspC as target for antiinfective drug discovery: synthesis, enantiomeric separation, and structural biology of fosmidomycin thia isosters.
Kunfermann A, Lienau C, Illarionov B, Held J, Gräwert T, Behrendt CT, Werner P, Hähn S, Eisenreich W, Riederer U, Mordmüller B, Bacher A, Fischer M, Groll M, Kurz T.
J Med Chem (2013) 56 : 8151 -8162
PubMed 24032981 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 25 6.60 8.29

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2431003 1 8.29
CHEMBL2431008 1 8.23
CHEMBL2431006 1 8.09
CHEMBL2431007 1 8.07
CHEMBL2431010 1 7.48
CHEMBL2431013 1 7.36
CHEMBL2431012 1 7.11
CHEMBL1830118 1 6.93
CHEMBL2431009 1 6.85
CHEMBL1830114 1 6.75
CHEMBL2164263 1 6.70
CHEMBL1830119 1 6.68
CHEMBL203125 FOSMIDOMYCIN 3.0 1 6.66
CHEMBL2164262 1 6.62
CHEMBL2164255 1 6.61
CHEMBL2164256 1 6.54
CHEMBL2164264 1 6.50
CHEMBL2431005 1 6.23
CHEMBL2431011 1 6.22
CHEMBL2164258 1 6.03
CHEMBL1830117 1 5.42
CHEMBL2431004 1 5.40
CHEMBL2164259 1 5.34
CHEMBL2164266 1 4.70
CHEMBL2431014 1 4.31

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2431003 IC50 = 5.1 nM 8.29
CHEMBL2431008 IC50 = 5.9 nM 8.23
CHEMBL2431006 IC50 = 8.2 nM 8.09
CHEMBL2431007 IC50 = 8.5 nM 8.07
CHEMBL2431010 IC50 = 33.0 nM 7.48
CHEMBL2431013 IC50 = 44.0 nM 7.36
CHEMBL2431012 IC50 = 77.0 nM 7.11
CHEMBL1830118 IC50 = 117.0 nM 6.93
CHEMBL2431009 IC50 = 140.0 nM 6.85
CHEMBL1830114 IC50 = 178.0 nM 6.75
CHEMBL2164263 IC50 = 200.0 nM 6.70
CHEMBL1830119 IC50 = 208.0 nM 6.68
CHEMBL203125 FOSMIDOMYCIN IC50 = 221.0 nM 6.66
CHEMBL2164262 IC50 = 240.0 nM 6.62
CHEMBL2164255 IC50 = 243.0 nM 6.61
CHEMBL2164256 IC50 = 286.0 nM 6.54
CHEMBL2164264 IC50 = 320.0 nM 6.50
CHEMBL2431005 IC50 = 592.0 nM 6.23
CHEMBL2431011 IC50 = 600.0 nM 6.22
CHEMBL2164258 IC50 = 940.0 nM 6.03
CHEMBL1830117 IC50 = 3830.0 nM 5.42
CHEMBL2431004 IC50 = 4000.0 nM 5.40
CHEMBL2164259 IC50 = 4600.0 nM 5.34
CHEMBL2164266 IC50 = 20000.0 nM 4.70
CHEMBL2431014 IC50 = 49000.0 nM 4.31