Assay Detail
Binding
CHEMBL941165
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Inhibition of human recombinant squalene synthase expressed in Escherichia coli BL21 (DE3) cells assessed as formation of 1,10-dioic acid metabolite by liquid scintillation
38
Total Activities
38
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Cell Type | BL21-DE3 |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Phosphonosulfonates are potent, selective inhibitors of dehydrosqualene synthase and staphyloxanthin biosynthesis in Staphylococcus aureus.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 38 | 6.97 | 9.00 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL460895 | — | — | 1 | 9.00 |
| CHEMBL490300 | — | — | 1 | 8.70 |
| CHEMBL460896 | — | — | 1 | 8.52 |
| CHEMBL160318 | — | — | 1 | 8.52 |
| CHEMBL490890 | — | — | 1 | 8.40 |
| CHEMBL515716 | — | — | 1 | 8.30 |
| CHEMBL473343 | — | — | 1 | 8.10 |
| CHEMBL489113 | — | — | 1 | 7.85 |
| CHEMBL461778 | — | — | 1 | 7.77 |
| CHEMBL490690 | — | — | 1 | 7.70 |
| CHEMBL473741 | — | — | 1 | 7.70 |
| CHEMBL351151 | — | — | 1 | 7.64 |
| CHEMBL522608 | — | — | 1 | 7.50 |
| CHEMBL499922 | — | — | 1 | 7.48 |
| CHEMBL516044 | — | — | 1 | 7.38 |
| CHEMBL473344 | — | — | 1 | 7.16 |
| CHEMBL473739 | — | — | 1 | 7.16 |
| CHEMBL513622 | — | — | 1 | 7.14 |
| CHEMBL473738 | — | — | 1 | 7.10 |
| CHEMBL158844 | — | — | 1 | 6.89 |
| CHEMBL460912 | — | — | 1 | 6.77 |
| CHEMBL474135 | — | — | 1 | 6.75 |
| CHEMBL516975 | — | — | 1 | 6.66 |
| CHEMBL160284 | — | — | 1 | 6.54 |
| CHEMBL513790 | — | — | 1 | 6.46 |
| CHEMBL473937 | — | — | 1 | 6.33 |
| CHEMBL491875 | — | — | 1 | 6.27 |
| CHEMBL473737 | — | — | 1 | 6.26 |
| CHEMBL514788 | — | — | 1 | 6.14 |
| CHEMBL490494 | — | — | 1 | 6.10 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL460895 | — | IC50 | = | 1.0 | nM | 9.00 |
| CHEMBL490300 | — | IC50 | = | 2.0 | nM | 8.70 |
| CHEMBL160318 | — | IC50 | = | 3.0 | nM | 8.52 |
| CHEMBL460896 | — | IC50 | = | 3.0 | nM | 8.52 |
| CHEMBL490890 | — | IC50 | = | 4.0 | nM | 8.40 |
| CHEMBL515716 | — | IC50 | = | 5.0 | nM | 8.30 |
| CHEMBL473343 | — | IC50 | = | 8.0 | nM | 8.10 |
| CHEMBL489113 | — | IC50 | = | 14.0 | nM | 7.85 |
| CHEMBL461778 | — | IC50 | = | 17.0 | nM | 7.77 |
| CHEMBL490690 | — | IC50 | = | 20.0 | nM | 7.70 |
| CHEMBL473741 | — | IC50 | = | 20.0 | nM | 7.70 |
| CHEMBL351151 | — | IC50 | = | 23.0 | nM | 7.64 |
| CHEMBL522608 | — | IC50 | = | 32.0 | nM | 7.50 |
| CHEMBL499922 | — | IC50 | = | 33.0 | nM | 7.48 |
| CHEMBL516044 | — | IC50 | = | 42.0 | nM | 7.38 |
| CHEMBL473344 | — | IC50 | = | 69.0 | nM | 7.16 |
| CHEMBL473739 | — | IC50 | = | 69.0 | nM | 7.16 |
| CHEMBL513622 | — | IC50 | = | 72.0 | nM | 7.14 |
| CHEMBL473738 | — | IC50 | = | 79.0 | nM | 7.10 |
| CHEMBL158844 | — | IC50 | = | 130.0 | nM | 6.89 |
| CHEMBL460912 | — | IC50 | = | 170.0 | nM | 6.77 |
| CHEMBL474135 | — | IC50 | = | 180.0 | nM | 6.75 |
| CHEMBL516975 | — | IC50 | = | 220.0 | nM | 6.66 |
| CHEMBL160284 | — | IC50 | = | 290.0 | nM | 6.54 |
| CHEMBL513790 | — | IC50 | = | 350.0 | nM | 6.46 |
| CHEMBL473937 | — | IC50 | = | 470.0 | nM | 6.33 |
| CHEMBL491875 | — | IC50 | = | 540.0 | nM | 6.27 |
| CHEMBL473737 | — | IC50 | = | 550.0 | nM | 6.26 |
| CHEMBL514788 | — | IC50 | = | 720.0 | nM | 6.14 |
| CHEMBL490494 | — | IC50 | = | 790.0 | nM | 6.10 |
| CHEMBL491874 | — | IC50 | = | 1100.0 | nM | 5.96 |
| CHEMBL461788 | — | IC50 | = | 1800.0 | nM | 5.75 |
| CHEMBL460718 | — | IC50 | = | 1900.0 | nM | 5.72 |
| CHEMBL462651 | — | IC50 | = | 1900.0 | nM | 5.72 |
| CHEMBL160340 | — | IC50 | = | 1900.0 | nM | 5.72 |
| CHEMBL461965 | — | IC50 | = | 3700.0 | nM | 5.43 |
| CHEMBL473742 | — | IC50 | = | 4000.0 | nM | 5.40 |
| CHEMBL473934 | — | IC50 | = | 11700.0 | nM | 4.93 |