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Assay Detail

CHEMBL5539625

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Binding
Inhibition of Staphylococcus aureus sortase A N24 deletion mutant using Abz-LPATG-Dnp as substrate preincubated for 20 mins followed by substrate addition by FRET assay
ChEMBL ↗
57
Total Activities
57
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Staphylococcus aureus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Sortase A (CHEMBL5362) ↗
Type SINGLE PROTEIN
Organism Staphylococcus aureus

Publication

Structure-Guided Design, Synthesis, and Antivirulence Assessment of Covalent <i>Staphylococcus aureus</i> Sortase A Inhibitors.
Yue C, Yuan Z, Xu G, Guan XN, Wei B, Yao H, Yang CG, Zhang T.
J Med Chem (2024) 67 : 1127 -1146
PubMed 38170998 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 57 5.82 6.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5573262 — — 1 6.30
CHEMBL5574890 — — 1 6.30
CHEMBL5570289 — — 1 6.22
CHEMBL5568652 — — 1 6.16
CHEMBL5572974 — — 1 6.16
CHEMBL5574464 — — 1 6.16
CHEMBL5569374 — — 1 6.16
CHEMBL5565857 — — 1 6.10
CHEMBL5564769 — — 1 6.10
CHEMBL5565682 — — 1 6.05
CHEMBL5571442 — — 1 6.00
CHEMBL5574266 — — 1 6.00
CHEMBL5563674 — — 1 6.00
CHEMBL5571234 — — 1 6.00
CHEMBL5566139 — — 1 6.00
CHEMBL5174805 — — 1 6.00
CHEMBL270142 — — 1 5.96
CHEMBL5574795 — — 1 5.96
CHEMBL5569180 — — 1 5.89
CHEMBL5570202 — — 1 5.89
CHEMBL5575994 — — 1 5.85
CHEMBL5572375 — — 1 5.85
CHEMBL5573199 — — 1 5.82
CHEMBL5569124 — — 1 5.80
CHEMBL5573956 — — 1 5.77
CHEMBL5590790 — — 1 5.75
CHEMBL5570130 — — 1 5.75
CHEMBL5572838 — — 1 5.75
CHEMBL5574258 — — 1 5.70
CHEMBL5565015 — — 1 5.70

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5573262 — IC50 = 500.0 nM 6.30
CHEMBL5574890 — IC50 = 500.0 nM 6.30
CHEMBL5570289 — IC50 = 600.0 nM 6.22
CHEMBL5568652 — IC50 = 700.0 nM 6.16
CHEMBL5572974 — IC50 = 700.0 nM 6.16
CHEMBL5574464 — IC50 = 700.0 nM 6.16
CHEMBL5569374 — IC50 = 700.0 nM 6.16
CHEMBL5565857 — IC50 = 800.0 nM 6.10
CHEMBL5564769 — IC50 = 800.0 nM 6.10
CHEMBL5565682 — IC50 = 900.0 nM 6.05
CHEMBL5563674 — IC50 = 1000.0 nM 6.00
CHEMBL5571442 — IC50 = 1000.0 nM 6.00
CHEMBL5574266 — IC50 = 1000.0 nM 6.00
CHEMBL5174805 — IC50 = 1000.0 nM 6.00
CHEMBL5571234 — IC50 = 1000.0 nM 6.00
CHEMBL5566139 — IC50 = 1000.0 nM 6.00
CHEMBL270142 — IC50 = 1100.0 nM 5.96
CHEMBL5574795 — IC50 = 1100.0 nM 5.96
CHEMBL5569180 — IC50 = 1300.0 nM 5.89
CHEMBL5570202 — IC50 = 1300.0 nM 5.89
CHEMBL5572375 — IC50 = 1400.0 nM 5.85
CHEMBL5575994 — IC50 = 1400.0 nM 5.85
CHEMBL5573199 — IC50 = 1500.0 nM 5.82
CHEMBL5569124 — IC50 = 1600.0 nM 5.80
CHEMBL5573956 — IC50 = 1700.0 nM 5.77
CHEMBL5590790 — IC50 = 1800.0 nM 5.75
CHEMBL5572838 — IC50 = 1800.0 nM 5.75
CHEMBL5570130 — IC50 = 1800.0 nM 5.75
CHEMBL5574258 — IC50 = 2000.0 nM 5.70
CHEMBL5565015 — IC50 = 2000.0 nM 5.70
CHEMBL5590938 — IC50 = 2100.0 nM 5.68
CHEMBL5567448 — IC50 = 2100.0 nM 5.68
CHEMBL5590936 — IC50 = 2200.0 nM 5.66
CHEMBL5564809 — IC50 = 2300.0 nM 5.64
CHEMBL5572271 — IC50 = 2500.0 nM 5.60
CHEMBL5591347 — IC50 = 2500.0 nM 5.60
CHEMBL1714230 — IC50 = 2800.0 nM 5.55
CHEMBL5589882 — IC50 = 4700.0 nM 5.33
CHEMBL5574358 — IC50 = 5600.0 nM 5.25
CHEMBL5570593 — IC50 = 6500.0 nM 5.19
CHEMBL5569985 — IC50 = 6900.0 nM 5.16
CHEMBL5570780 — IC50 = 7700.0 nM 5.11
CHEMBL5583741 — IC50 > 50000.0 nM -
CHEMBL5576002 — IC50 > 50000.0 nM -
CHEMBL5575728 — IC50 > 50000.0 nM -
CHEMBL5572091 — IC50 > 50000.0 nM -
CHEMBL5574597 — IC50 > 50000.0 nM -
CHEMBL5564770 — IC50 > 50000.0 nM -
CHEMBL5591018 — IC50 > 50000.0 nM -
CHEMBL5570789 — IC50 > 50000.0 nM -