Assay Detail
Binding
CHEMBL4376060
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Binding affinity to recombinant human KEAP1 Kelch domain (321 to 609 residues) expressed in Escherichia coli BL21 (DE3) assessed as thermal stabilization by sypro orange dye based thermal shift assay
20
Total Activities
19
Compounds Tested
2
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
Kelch-like ECH-associated protein 1 (CHEMBL2069156) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
A Comparative Assessment Study of Known Small-Molecule Keap1-Nrf2 Protein-Protein Interaction Inhibitors: Chemical Synthesis, Binding Properties, and Cellular Activity.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| EC50 | 19 | 5.02 | 5.72 |
| Activity | 1 | - | - |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3819587 | — | — | 1 | 5.72 |
| CHEMBL2402207 | — | — | 1 | 5.24 |
| CHEMBL3237245 | — | — | 1 | 5.23 |
| CHEMBL4077198 | — | — | 1 | 5.14 |
| CHEMBL4440989 | — | — | 1 | 5.00 |
| CHEMBL3632711 | — | — | 1 | 4.92 |
| CHEMBL4534676 | — | — | 1 | 4.89 |
| CHEMBL3899754 | — | — | 1 | 4.89 |
| CHEMBL3423015 | — | — | 1 | 4.60 |
| CHEMBL2381968 | — | — | 1 | 4.58 |
| CHEMBL2402206 | — | — | 2 | - |
| CHEMBL3617836 | — | — | 1 | - |
| CHEMBL4167734 | — | — | 1 | - |
| CHEMBL4576082 | — | — | 1 | - |
| CHEMBL4164286 | — | — | 1 | - |
| CHEMBL4166691 | — | — | 1 | - |
| CHEMBL3134423 | — | — | 1 | - |
| CHEMBL3235901 | — | — | 1 | - |
| CHEMBL256097 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3819587 | — | EC50 | = | 1900.0 | nM | 5.72 |
| CHEMBL2402207 | — | EC50 | = | 5800.0 | nM | 5.24 |
| CHEMBL3237245 | — | EC50 | = | 5900.0 | nM | 5.23 |
| CHEMBL4077198 | — | EC50 | = | 7200.0 | nM | 5.14 |
| CHEMBL4440989 | — | EC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL3632711 | — | EC50 | = | 12000.0 | nM | 4.92 |
| CHEMBL4534676 | — | EC50 | = | 13000.0 | nM | 4.89 |
| CHEMBL3899754 | — | EC50 | = | 13000.0 | nM | 4.89 |
| CHEMBL3423015 | — | EC50 | = | 25000.0 | nM | 4.60 |
| CHEMBL2381968 | — | EC50 | = | 26000.0 | nM | 4.58 |
| CHEMBL2402206 | — | EC50 | = | 110000.0 | nM | - |
| CHEMBL3617836 | — | EC50 | <= | 100000.0 | nM | - |
| CHEMBL4167734 | — | EC50 | <= | 77000.0 | nM | - |
| CHEMBL4576082 | — | EC50 | <= | 800000.0 | nM | - |
| CHEMBL4164286 | — | EC50 | <= | 800000.0 | nM | - |
| CHEMBL4166691 | — | EC50 | <= | 99000.0 | nM | - |
| CHEMBL3134423 | — | EC50 | <= | 49000.0 | nM | - |
| CHEMBL3235901 | — | EC50 | <= | 50000.0 | nM | - |
| CHEMBL256097 | — | EC50 | <= | 25000.0 | nM | - |
| CHEMBL2402206 | — | Activity | - | — | - |