Compound Detail
CHEMBL5759520
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Basic Information
| ChEMBL ID | CHEMBL5759520 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VOLJUDGKGGWKBS-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
421.5
MW (Da)
2.63
ALogP
7
HBA
2
HBD
93.3
PSA (Ų)
0.37
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone deacetylase 6 CHEMBL1865 | IC50 | 7.96 | 7.96 | 11.0 | 1 |
| Histone deacetylase 8 CHEMBL3192 | IC50 | 6.54 | 6.54 | 287.0 | 1 |
| Histone deacetylase 11 CHEMBL3310 | IC50 | 5.0 | 5.0 | 10020.0 | 1 |
| Histone deacetylase 1 CHEMBL325 | IC50 | 4.97 | 4.97 | 10700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone deacetylase 6 | IC50 | = | 11.0 | nM | 7.96 | Enzymatic Assay: The IC50 values for aforementioned compounds against HDACs were... | - |
| Histone deacetylase 8 | IC50 | = | 287.0 | nM | 6.54 | Enzymatic Assay: The IC50 values for aforementioned compounds against HDACs were... | - |
| Histone deacetylase 11 | IC50 | = | 10020.0 | nM | 5.0 | Enzymatic Assay: The IC50 values for aforementioned compounds against HDACs were... | - |
| Histone deacetylase 1 | IC50 | = | 10700.0 | nM | 4.97 | Enzymatic Assay: The IC50 values for aforementioned compounds against HDACs were... | - |
Data from ChEMBL 36 via Core Engine