Compound Detail
CHEMBL1672332
BUTYRYLHYDROXAMIC ACID Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1672332 |
| Name | BUTYRYLHYDROXAMIC ACID |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CCBCHURBDSNSTJ-UHFFFAOYSA-N |
5
Targets
6
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
103.1
MW (Da)
0.29
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.39
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 5.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone deacetylase 6 CHEMBL1865 | IC50 | 5.7 | 5.7 | 2000.0 | 1 |
| Histone deacetylase 1 CHEMBL325 | IC50 | 5.16 | 5.16 | 7000.0 | 1 |
| Histone deacetylase 2 CHEMBL1937 | IC50 | 5.05 | 5.05 | 9000.0 | 1 |
| Histone deacetylase 3 CHEMBL1829 | IC50 | 5.0 | 5.0 | 10000.0 | 1 |
| Histone deacetylase 8 CHEMBL3192 | IC50 | 4.58 | 4.58 | 26000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone deacetylase 6 | IC50 | = | 2000.0 | nM | 5.7 | Inhibition of human recombinant HDAC6 | 21874153 |
| Histone deacetylase 1 | IC50 | = | 7000.0 | nM | 5.16 | Inhibition of human recombinant HDAC1 | 21874153 |
| Histone deacetylase 2 | IC50 | = | 9000.0 | nM | 5.05 | Inhibition of human recombinant HDAC2 | 21874153 |
| Histone deacetylase 3 | IC50 | = | 10000.0 | nM | 5.0 | Inhibition of human recombinant HDAC3 | 21874153 |
| Histone deacetylase 8 | IC50 | = | 26000.0 | nM | 4.58 | Inhibition of human recombinant HDAC8 | 21874153 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21874153 | 10.1021/ml1001954 | Histone deacetylase 6 | 2 |
| 21874153 | 10.1021/ml1001954 | Histone deacetylase 1 | 1 |
| 21874153 | 10.1021/ml1001954 | Histone deacetylase 2 | 1 |
| 21874153 | 10.1021/ml1001954 | Histone deacetylase 3 | 1 |
| 21874153 | 10.1021/ml1001954 | Histone deacetylase 8 | 1 |
| 21874153 | 10.1021/ml1001954 | Histone deacetylase 4 | 1 |
| 21874153 | 10.1021/ml1001954 | Histone deacetylase 5 | 1 |
| 21874153 | 10.1021/ml1001954 | Histone deacetylase 7 | 1 |
| 21874153 | 10.1021/ml1001954 | Histone deacetylase 9 | 1 |
| 21874153 | 10.1021/ml1001954 | Histone deacetylase | 1 |
| 21874153 | 10.1021/ml1001954 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine