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Assay Detail

CHEMBL716780

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Binding
Compound tested for inhibition of Staphylococcus aureus MRS (methionyl tRNA synthetase) in aminoacylation assay
37
Total Activities
37
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Staphylococcus aureus
Confidence 8 — Homologous single protein target
Curated By Expert

Target

Methionine--tRNA ligase (CHEMBL3367)
Type SINGLE PROTEIN
Organism Escherichia coli K-12

Publication

Optimisation of aryl substitution leading to potent methionyl tRNA synthetase inhibitors with excellent gram-positive antibacterial activity.
Jarvest RL, Berge JM, Brown MJ, Brown P, Elder JS, Forrest AK, Houge-Frydrych CS, O'Hanlon PJ, McNair DJ, Rittenhouse S, Sheppard RJ.
Bioorg Med Chem Lett (2003) 13 : 665 -668
PubMed 12639554 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 37 8.01 8.49

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL158758 1 8.49
CHEMBL158555 1 8.48
CHEMBL162534 1 8.42
CHEMBL159092 1 8.41
CHEMBL159035 1 8.40
CHEMBL157589 1 8.39
CHEMBL162356 1 8.37
CHEMBL159217 1 8.29
CHEMBL161152 1 8.29
CHEMBL422699 1 8.24
CHEMBL159068 1 8.22
CHEMBL158513 1 8.17
CHEMBL158958 1 8.17
CHEMBL161255 1 8.14
CHEMBL157867 1 8.11
CHEMBL161213 1 8.10
CHEMBL304237 1 8.10
CHEMBL436610 1 8.03
CHEMBL161212 1 8.03
CHEMBL158904 1 8.03
CHEMBL160444 1 7.92
CHEMBL423780 1 7.92
CHEMBL58615 1 7.92
CHEMBL160445 1 7.89
CHEMBL345813 1 7.85
CHEMBL60402 1 7.80
CHEMBL352166 1 7.77
CHEMBL346042 1 7.68
CHEMBL424342 1 7.68
CHEMBL347809 1 7.64

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL158758 IC50 = 3.2 nM 8.49
CHEMBL158555 IC50 = 3.3 nM 8.48
CHEMBL162534 IC50 = 3.8 nM 8.42
CHEMBL159092 IC50 = 3.9 nM 8.41
CHEMBL159035 IC50 = 4.0 nM 8.40
CHEMBL157589 IC50 = 4.1 nM 8.39
CHEMBL162356 IC50 = 4.3 nM 8.37
CHEMBL159217 IC50 = 5.1 nM 8.29
CHEMBL161152 IC50 = 5.1 nM 8.29
CHEMBL422699 IC50 = 5.7 nM 8.24
CHEMBL159068 IC50 = 6.0 nM 8.22
CHEMBL158513 IC50 = 6.8 nM 8.17
CHEMBL158958 IC50 = 6.8 nM 8.17
CHEMBL161255 IC50 = 7.2 nM 8.14
CHEMBL157867 IC50 = 7.8 nM 8.11
CHEMBL161213 IC50 = 8.0 nM 8.10
CHEMBL304237 IC50 = 8.0 nM 8.10
CHEMBL158904 IC50 = 9.4 nM 8.03
CHEMBL161212 IC50 = 9.4 nM 8.03
CHEMBL436610 IC50 = 9.4 nM 8.03
CHEMBL160444 IC50 = 12.0 nM 7.92
CHEMBL423780 IC50 = 12.0 nM 7.92
CHEMBL58615 IC50 = 12.0 nM 7.92
CHEMBL160445 IC50 = 13.0 nM 7.89
CHEMBL345813 IC50 = 14.0 nM 7.85
CHEMBL60402 IC50 = 16.0 nM 7.80
CHEMBL352166 IC50 = 17.0 nM 7.77
CHEMBL424342 IC50 = 21.0 nM 7.68
CHEMBL346042 IC50 = 21.0 nM 7.68
CHEMBL347809 IC50 = 23.0 nM 7.64
CHEMBL158642 IC50 = 23.0 nM 7.64
CHEMBL346109 IC50 = 120.0 nM 6.92
CHEMBL159207 IC50 = 170.0 nM 6.77
CHEMBL158051 IC50 < 3.0 nM -
CHEMBL161347 IC50 < 3.0 nM -
CHEMBL345835 IC50 < 3.0 nM -
CHEMBL161300 IC50 < 3.0 nM -