Assay Detail
Binding
CHEMBL709184
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Binding affinity towards matrix metalloprotease-3
40
Total Activities
40
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Confidence | 8 — Homologous single protein target |
| Curated By | Expert |
Publication
Three-dimensional quantitative structure-activity relationship (3D-QSAR) models for a novel class of piperazine-based stromelysin-1 (MMP-3) inhibitors: applying a "divide and conquer" strategy.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 40 | 7.49 | 8.60 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL126044 | — | — | 1 | 8.60 |
| CHEMBL123563 | — | — | 1 | 8.49 |
| CHEMBL123967 | — | — | 1 | 8.46 |
| CHEMBL123499 | — | — | 1 | 8.37 |
| CHEMBL333586 | — | — | 1 | 8.28 |
| CHEMBL123627 | — | — | 1 | 8.12 |
| CHEMBL338007 | — | — | 1 | 8.05 |
| CHEMBL338077 | — | — | 1 | 8.02 |
| CHEMBL435206 | — | — | 1 | 7.96 |
| CHEMBL419430 | — | — | 1 | 7.89 |
| CHEMBL124558 | — | — | 1 | 7.89 |
| CHEMBL331095 | — | — | 1 | 7.82 |
| CHEMBL127093 | — | — | 1 | 7.77 |
| CHEMBL332134 | — | — | 1 | 7.75 |
| CHEMBL332302 | — | — | 1 | 7.75 |
| CHEMBL125068 | — | — | 1 | 7.70 |
| CHEMBL125598 | — | — | 1 | 7.64 |
| CHEMBL340923 | — | — | 1 | 7.57 |
| CHEMBL125755 | — | — | 1 | 7.57 |
| CHEMBL124100 | — | — | 1 | 7.55 |
| CHEMBL126004 | — | — | 1 | 7.42 |
| CHEMBL123615 | — | — | 1 | 7.41 |
| CHEMBL126388 | — | — | 1 | 7.39 |
| CHEMBL124680 | — | — | 1 | 7.32 |
| CHEMBL339219 | — | — | 1 | 7.27 |
| CHEMBL339903 | — | — | 1 | 7.22 |
| CHEMBL123320 | — | — | 1 | 7.22 |
| CHEMBL125672 | — | — | 1 | 7.19 |
| CHEMBL421644 | — | — | 1 | 7.18 |
| CHEMBL124265 | — | — | 1 | 7.15 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL126044 | — | IC50 | = | 2.5 | nM | 8.60 |
| CHEMBL123563 | — | IC50 | = | 3.2 | nM | 8.49 |
| CHEMBL123967 | — | IC50 | = | 3.499 | nM | 8.46 |
| CHEMBL123499 | — | IC50 | = | 4.295 | nM | 8.37 |
| CHEMBL333586 | — | IC50 | = | 5.297 | nM | 8.28 |
| CHEMBL123627 | — | IC50 | = | 7.499 | nM | 8.12 |
| CHEMBL338007 | — | IC50 | = | 8.892 | nM | 8.05 |
| CHEMBL338077 | — | IC50 | = | 9.499 | nM | 8.02 |
| CHEMBL435206 | — | IC50 | = | 10.99 | nM | 7.96 |
| CHEMBL419430 | — | IC50 | = | 13.0 | nM | 7.89 |
| CHEMBL124558 | — | IC50 | = | 13.0 | nM | 7.89 |
| CHEMBL331095 | — | IC50 | = | 15.0 | nM | 7.82 |
| CHEMBL127093 | — | IC50 | = | 16.98 | nM | 7.77 |
| CHEMBL332134 | — | IC50 | = | 18.0 | nM | 7.75 |
| CHEMBL332302 | — | IC50 | = | 18.0 | nM | 7.75 |
| CHEMBL125068 | — | IC50 | = | 20.0 | nM | 7.70 |
| CHEMBL125598 | — | IC50 | = | 23.0 | nM | 7.64 |
| CHEMBL340923 | — | IC50 | = | 27.0 | nM | 7.57 |
| CHEMBL125755 | — | IC50 | = | 27.0 | nM | 7.57 |
| CHEMBL124100 | — | IC50 | = | 28.0 | nM | 7.55 |
| CHEMBL126004 | — | IC50 | = | 38.0 | nM | 7.42 |
| CHEMBL123615 | — | IC50 | = | 39.0 | nM | 7.41 |
| CHEMBL126388 | — | IC50 | = | 41.0 | nM | 7.39 |
| CHEMBL124680 | — | IC50 | = | 48.0 | nM | 7.32 |
| CHEMBL339219 | — | IC50 | = | 54.0 | nM | 7.27 |
| CHEMBL339903 | — | IC50 | = | 60.01 | nM | 7.22 |
| CHEMBL123320 | — | IC50 | = | 60.01 | nM | 7.22 |
| CHEMBL125672 | — | IC50 | = | 65.01 | nM | 7.19 |
| CHEMBL421644 | — | IC50 | = | 66.07 | nM | 7.18 |
| CHEMBL124265 | — | IC50 | = | 71.01 | nM | 7.15 |
| CHEMBL124026 | — | IC50 | = | 74.99 | nM | 7.12 |
| CHEMBL338223 | — | IC50 | = | 114.0 | nM | 6.94 |
| CHEMBL125384 | — | IC50 | = | 123.88 | nM | 6.91 |
| CHEMBL436580 | — | IC50 | = | 146.99 | nM | 6.83 |
| CHEMBL124514 | — | IC50 | = | 174.98 | nM | 6.76 |
| CHEMBL338453 | — | IC50 | = | 172.98 | nM | 6.76 |
| CHEMBL125281 | — | IC50 | = | 184.08 | nM | 6.74 |
| CHEMBL124681 | — | IC50 | = | 269.15 | nM | 6.57 |
| CHEMBL125601 | — | IC50 | = | 385.48 | nM | 6.41 |
| CHEMBL419607 | — | IC50 | = | 410.02 | nM | 6.39 |