Compound Detail
CHEMBL152665
PHENYLACETOHYDROXAMIC ACID Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL152665 |
| Name | PHENYLACETOHYDROXAMIC ACID |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FPOQLQZHRCEVOT-UHFFFAOYSA-N |
5
Targets
7
Activities
1
Assay Types
1
PK Parameters
19
Publications
0
Known Names
Molecular Properties
151.2
MW (Da)
0.73
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.48
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 7 meas. best 6.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Polyunsaturated fatty acid 5-lipoxygenase CHEMBL312 | IC50 | 6.8 | 6.8 | 158.5 | 1 |
| Histone deacetylase 6 CHEMBL1865 | IC50 | 5.96 | 5.96 | 1100.0 | 1 |
| MDA-MB-231 CHEMBL400 | IC50 | 5.01 | 5.01 | 9720.0 | 1 |
| Histone deacetylase 8 CHEMBL3192 | IC50 | 4.93 | 4.93 | 11620.0 | 1 |
| Elastase CHEMBL1075146 | IC50 | 4.87 | 4.87 | 13600.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 24.0 | hr | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Polyunsaturated fatty acid 5-lipoxygenase | IC50 | = | 158.49 | nM | 6.8 | Logarithmic value of inhibitory concentration against 5-lipoxygenase in rat baso... | 2308149 |
| Histone deacetylase 6 | IC50 | = | 1100.0 | nM | 5.96 | Inhibition of HDAC6 (unknown origin) assessed as fluorescence intensity measured... | 23368884 |
| MDA-MB-231 | IC50 | = | 9720.0 | nM | 5.01 | Cytotoxicity against human MDA-MB-231 cells assessed as decrease in cell prolife... | 28262526 |
| Histone deacetylase 8 | IC50 | = | 11620.0 | nM | 4.93 | Inhibition of HDAC8 (unknown origin) assessed as fluorescence intensity measured... | 23368884 |
| Elastase | IC50 | = | 13600.0 | nM | 4.87 | Antagonist activity at Pseudomonas aeruginosa LasB using Abz-Ala-Gly-Leu-Ala-p-N... | 23181168 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20017493 | 10.1021/jm901502p | Histone deacetylase | 3 |
| 23181168 | 10.1021/ml300128f | Elastase | 3 |
| 28262526 | 10.1016/j.bmcl.2017.01.080 | MDA-MB-231 | 2 |
| 2308149 | 10.1021/jm00165a017 | Polyunsaturated fatty acid 5-lipoxygenase | 2 |
| 23181168 | 10.1021/ml300128f | No relevant target | 2 |
| 21859126 | 10.1021/jm200794r | HeLa | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B1 | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B3 | 1 |
| 23368884 | 10.1021/jm301355j | Histone deacetylase 2 | 1 |
| 23368884 | 10.1021/jm301355j | Histone deacetylase 4 | 1 |
| 23368884 | 10.1021/jm301355j | Histone deacetylase 6 | 1 |
| 23368884 | 10.1021/jm301355j | Histone deacetylase 8 | 1 |
| 21859126 | 10.1021/jm200794r | PC-3 | 1 |
| 21859126 | 10.1021/jm200794r | MCF7 | 1 |
| 21859126 | 10.1021/jm200794r | Micrococcus luteus | 1 |
| 19888756 | 10.1021/jm9012592 | Unchecked | 1 |
| 19821586 | 10.1021/jm900648x | No relevant target | 1 |
| 19821586 | 10.1021/jm900648x | Plasma | 1 |
| 3820229 | 10.1021/jm00386a022 | Polyunsaturated fatty acid 5-lipoxygenase | 1 |
Data from ChEMBL 36 via Core Engine