Assay Detail
ADMET
CHEMBL4000925
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Inhibition of APMA-activated recombinant human MMP-2 using Cy3-PLGLK(Cy5Q)AR-NH2 peptide as substrate measured after 40 mins by spectrofluorimetric method
12
Total Activities
12
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Discovery of Novel, Highly Potent, and Selective Matrix Metalloproteinase (MMP)-13 Inhibitors with a 1,2,4-Triazol-3-yl Moiety as a Zinc Binding Group Using a Structure-Based Design Approach.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 12 | 7.04 | 10.54 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL440498 | CTS-1027 | 2.0 | 1 | 10.54 |
| CHEMBL4068241 | — | — | 1 | 7.85 |
| CHEMBL4092215 | — | — | 1 | 7.21 |
| CHEMBL4083954 | — | — | 1 | 7.08 |
| CHEMBL4068176 | — | — | 1 | 6.75 |
| CHEMBL4073102 | — | — | 1 | 6.64 |
| CHEMBL3337869 | — | — | 1 | 6.52 |
| CHEMBL4094673 | — | — | 1 | 6.18 |
| CHEMBL4102420 | — | — | 1 | 6.17 |
| CHEMBL1511860 | — | — | 1 | 5.44 |
| CHEMBL4064516 | — | — | 1 | - |
| CHEMBL4074167 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL440498 | CTS-1027 | IC50 | = | 0.029 | nM | 10.54 |
| CHEMBL4068241 | — | IC50 | = | 14.0 | nM | 7.85 |
| CHEMBL4092215 | — | IC50 | = | 62.0 | nM | 7.21 |
| CHEMBL4083954 | — | IC50 | = | 83.0 | nM | 7.08 |
| CHEMBL4068176 | — | IC50 | = | 180.0 | nM | 6.75 |
| CHEMBL4073102 | — | IC50 | = | 230.0 | nM | 6.64 |
| CHEMBL3337869 | — | IC50 | = | 300.0 | nM | 6.52 |
| CHEMBL4094673 | — | IC50 | = | 660.0 | nM | 6.18 |
| CHEMBL4102420 | — | IC50 | = | 670.0 | nM | 6.17 |
| CHEMBL1511860 | — | IC50 | = | 3600.0 | nM | 5.44 |
| CHEMBL4064516 | — | IC50 | - | — | - | |
| CHEMBL4074167 | — | IC50 | > | 1000.0 | nM | - |