Assay Detail
ADMET
CHEMBL4059436
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Binding affinity to human N-terminal 6His-tagged HSP90alpha (1 to 236 residues) expressed in Escherichia coli BL21star/Rosetta2 (DE3) at 298 K by ITC assay
3
Total Activities
3
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
Structure Based Design of a Grp94-Selective Inhibitor: Exploiting a Key Residue in Grp94 To Optimize Paralog-Selective Binding.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Kd | 3 | 6.36 | 6.50 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4075556 | — | — | 1 | 6.50 |
| CHEMBL3426787 | — | — | 1 | 6.21 |
| CHEMBL4098757 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4075556 | — | Kd | = | 320.0 | nM | 6.50 |
| CHEMBL3426787 | — | Kd | = | 620.0 | nM | 6.21 |
| CHEMBL4098757 | — | Kd | - | — | - |