Assay Detail
Binding
CHEMBL4817143
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Inhibition of bacterial Beta-lactamase KPC-2 (29 - 289) (unknown origin) expressed in Escherichia coli Transetta (DE3)
22
Total Activities
22
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Bacteria |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Discovery of 3-aryl substituted benzoxaboroles as broad-spectrum inhibitors of serine- and metallo-β-lactamases.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 22 | 6.33 | 8.43 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1689063 | AVIBACTAM | 4.0 | 1 | 8.43 |
| CHEMBL4855048 | — | — | 1 | 7.07 |
| CHEMBL4875825 | — | — | 1 | 7.00 |
| CHEMBL4875926 | — | — | 1 | 6.75 |
| CHEMBL4866950 | — | — | 1 | 6.75 |
| CHEMBL4861004 | — | — | 1 | 6.70 |
| CHEMBL4871947 | — | — | 1 | 6.66 |
| CHEMBL4875141 | — | — | 1 | 6.46 |
| CHEMBL4861951 | — | — | 1 | 6.44 |
| CHEMBL4878895 | — | — | 1 | 6.39 |
| CHEMBL4861373 | — | — | 1 | 6.29 |
| CHEMBL4879305 | — | — | 1 | 6.12 |
| CHEMBL4858119 | — | — | 1 | 6.09 |
| CHEMBL4864824 | — | — | 1 | 6.00 |
| CHEMBL4856812 | — | — | 1 | 5.72 |
| CHEMBL4849046 | — | — | 1 | 5.62 |
| CHEMBL4875860 | — | — | 1 | 5.59 |
| CHEMBL4878058 | — | — | 1 | 5.18 |
| CHEMBL4864629 | — | — | 1 | 5.03 |
| CHEMBL4851510 | — | — | 1 | - |
| CHEMBL4872823 | — | — | 1 | - |
| CHEMBL4864134 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1689063 | AVIBACTAM | IC50 | = | 3.7 | nM | 8.43 |
| CHEMBL4855048 | — | IC50 | = | 86.0 | nM | 7.07 |
| CHEMBL4875825 | — | IC50 | = | 100.0 | nM | 7.00 |
| CHEMBL4875926 | — | IC50 | = | 180.0 | nM | 6.75 |
| CHEMBL4866950 | — | IC50 | = | 180.0 | nM | 6.75 |
| CHEMBL4861004 | — | IC50 | = | 200.0 | nM | 6.70 |
| CHEMBL4871947 | — | IC50 | = | 220.0 | nM | 6.66 |
| CHEMBL4875141 | — | IC50 | = | 350.0 | nM | 6.46 |
| CHEMBL4861951 | — | IC50 | = | 360.0 | nM | 6.44 |
| CHEMBL4878895 | — | IC50 | = | 410.0 | nM | 6.39 |
| CHEMBL4861373 | — | IC50 | = | 510.0 | nM | 6.29 |
| CHEMBL4879305 | — | IC50 | = | 760.0 | nM | 6.12 |
| CHEMBL4858119 | — | IC50 | = | 810.0 | nM | 6.09 |
| CHEMBL4864824 | — | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL4856812 | — | IC50 | = | 1910.0 | nM | 5.72 |
| CHEMBL4849046 | — | IC50 | = | 2410.0 | nM | 5.62 |
| CHEMBL4875860 | — | IC50 | = | 2580.0 | nM | 5.59 |
| CHEMBL4878058 | — | IC50 | = | 6560.0 | nM | 5.18 |
| CHEMBL4864629 | — | IC50 | = | 9430.0 | nM | 5.03 |
| CHEMBL4851510 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL4872823 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL4864134 | — | IC50 | > | 100000.0 | nM | - |