Assay Detail
Binding
CHEMBL938618
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Inhibition of Bacillus thermoproteolyticus thermolysin
36
Total Activities
12
Compounds Tested
2
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Bacillus thermoproteolyticus |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Discovery of potent thermolysin inhibitors using structure based virtual screening and binding assays.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 24 | 7.26 | 10.19 |
| Ki | 12 | 7.26 | 10.19 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL459183 | — | — | 3 | 10.19 |
| CHEMBL464808 | — | — | 3 | 4.33 |
| CHEMBL458112 | — | — | 3 | - |
| CHEMBL512058 | — | — | 3 | - |
| CHEMBL464807 | — | — | 3 | - |
| CHEMBL464535 | — | — | 3 | - |
| CHEMBL310555 | OXYQUINOLINE | -1.0 | 3 | - |
| CHEMBL459184 | — | — | 3 | - |
| CHEMBL459182 | — | — | 3 | - |
| CHEMBL449413 | — | — | 3 | - |
| CHEMBL458830 | — | — | 3 | - |
| CHEMBL458114 | — | — | 3 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL459183 | — | IC50 | = | 0.06397 | nM | 10.19 |
| CHEMBL459183 | — | Ki | = | 0.064 | nM | 10.19 |
| CHEMBL459183 | — | IC50 | = | 0.064 | nM | 10.19 |
| CHEMBL464808 | — | IC50 | = | 47000.0 | nM | 4.33 |
| CHEMBL464808 | — | IC50 | = | 46989.41 | nM | 4.33 |
| CHEMBL464808 | — | Ki | = | 47000.0 | nM | 4.33 |
| CHEMBL458112 | — | IC50 | = | 294060000.0 | nM | - |
| CHEMBL458112 | — | IC50 | = | 294060031.89 | nM | - |
| CHEMBL310555 | OXYQUINOLINE | Ki | = | 214000.0 | nM | - |
| CHEMBL310555 | OXYQUINOLINE | IC50 | = | 350000.0 | nM | - |
| CHEMBL310555 | OXYQUINOLINE | IC50 | = | 350000.0 | nM | - |
| CHEMBL464535 | — | Ki | = | 1450000.0 | nM | - |
| CHEMBL464535 | — | IC50 | = | 14539999.78 | nM | - |
| CHEMBL464535 | — | IC50 | = | 14540000.0 | nM | - |
| CHEMBL464807 | — | Ki | = | 2950000.0 | nM | - |
| CHEMBL464807 | — | IC50 | = | 29499998.91 | nM | - |
| CHEMBL464807 | — | IC50 | = | 29500000.0 | nM | - |
| CHEMBL512058 | — | Ki | = | 2060000.0 | nM | - |
| CHEMBL512058 | — | IC50 | = | 20580001.4 | nM | - |
| CHEMBL512058 | — | IC50 | = | 20580000.0 | nM | - |
| CHEMBL458112 | — | Ki | = | 294000000.0 | nM | - |
| CHEMBL459184 | — | IC50 | = | 91569997.01 | nM | - |
| CHEMBL458114 | — | Ki | = | 8140000.0 | nM | - |
| CHEMBL458114 | — | IC50 | = | 81410008.48 | nM | - |
| CHEMBL458114 | — | IC50 | = | 81410000.0 | nM | - |
| CHEMBL458830 | — | Ki | = | 161000000.0 | nM | - |
| CHEMBL458830 | — | IC50 | = | 161140015.1 | nM | - |
| CHEMBL458830 | — | IC50 | = | 161140000.0 | nM | - |
| CHEMBL459184 | — | IC50 | = | 91570000.0 | nM | - |
| CHEMBL449413 | — | IC50 | = | 697480066.04 | nM | - |
| CHEMBL449413 | — | IC50 | = | 697480000.0 | nM | - |
| CHEMBL459182 | — | Ki | = | 4810000.0 | nM | - |
| CHEMBL459182 | — | IC50 | = | 48130004.25 | nM | - |
| CHEMBL459182 | — | IC50 | = | 48130000.0 | nM | - |
| CHEMBL459184 | — | Ki | = | 9160000.0 | nM | - |
| CHEMBL449413 | — | Ki | = | 697000000.0 | nM | - |