Assay Detail
Binding
CHEMBL5230803
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of Metallo-beta-lactamase NDM-1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as substrate hydrolysis using imipenem as substrate by spectrometric analysis
6
Total Activities
6
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Bacteria |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Structure-based design of covalent inhibitors targeting metallo-β-lactamases.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 6 | 6.73 | 6.92 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL583959 | BIS(PYRROLIDINYLTHIOCARBONYL)DISULFIDE | — | 1 | 6.92 |
| CHEMBL964 | DISULFIRAM | 4.0 | 1 | 6.89 |
| CHEMBL121516 | BIS(PIPERIDINYLTHIOCARBONYL)DISULFIDE | — | 1 | 6.85 |
| CHEMBL5290744 | — | — | 1 | 6.66 |
| CHEMBL333177 | — | — | 1 | 6.58 |
| CHEMBL120082 | BIS(DIBENZYLAMINETHIOCARBONYL)DISULFIDE | — | 1 | 6.50 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL583959 | BIS(PYRROLIDINYLTHIOCARBONYL)DISULFIDE | IC50 | = | 120.0 | nM | 6.92 |
| CHEMBL964 | DISULFIRAM | IC50 | = | 130.0 | nM | 6.89 |
| CHEMBL121516 | BIS(PIPERIDINYLTHIOCARBONYL)DISULFIDE | IC50 | = | 140.0 | nM | 6.85 |
| CHEMBL5290744 | — | IC50 | = | 220.0 | nM | 6.66 |
| CHEMBL333177 | — | IC50 | = | 260.0 | nM | 6.58 |
| CHEMBL120082 | BIS(DIBENZYLAMINETHIOCARBONYL)DISULFIDE | IC50 | = | 320.0 | nM | 6.50 |