Compound Detail
CHEMBL69294
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Basic Information
| ChEMBL ID | CHEMBL69294 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZEWFPWKROPWRKE-BMAFSFTCSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
177.2
MW (Da)
-2.58
ALogP
5
HBA
5
HBD
93.0
PSA (Ų)
0.30
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 4 meas. best 8.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tissue alpha-L-fucosidase CHEMBL4176 | Ki | 8.24 | 8.24 | 5.8 | 3 |
| Plasma alpha-L-fucosidase CHEMBL2271 | Ki | 7.95 | 7.95 | 11.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tissue alpha-L-fucosidase | Ki | = | 5.8 | nM | 8.24 | Compound was tested for inhibitory activity (competitive) against alpha-L-fucosi... | - |
| Tissue alpha-L-fucosidase | Ki | = | 5.8 | nM | 8.24 | Inhibitory activity against alpha-L-fucosidase in bovine epididymis; Competitive... | 9873715 |
| Tissue alpha-L-fucosidase | Ki | = | 5.8 | nM | 8.24 | Tested for inhibitory activity against alpha-L-fucosidase from bovine epididymus... | - |
| Plasma alpha-L-fucosidase | Ki | = | 11.3 | nM | 7.95 | Tested for inhibitory activity against alpha-L-fucosidase from solubilised human... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)80711-3 | Tissue alpha-L-fucosidase | 2 |
| - | 10.1016/S0960-894X(01)80711-3 | Unchecked | 2 |
| - | 10.1016/0960-894X(95)00377-6 | Tissue alpha-L-fucosidase | 1 |
| 9873715 | 10.1016/s0960-894x(98)00596-4 | Tissue alpha-L-fucosidase | 1 |
| - | 10.1016/S0960-894X(01)80711-3 | Plasma alpha-L-fucosidase | 1 |
| - | 10.1016/S0960-894X(01)80711-3 | Alpha-galactosidase A | 1 |
Data from ChEMBL 36 via Core Engine