Compound Detail
CHEMBL166568
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Basic Information
| ChEMBL ID | CHEMBL166568 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VXCNNKUETLEVAO-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
306.3
MW (Da)
0.90
ALogP
5
HBA
2
HBD
113.4
PSA (Ų)
0.87
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Transmembrane prolyl 4-hydroxylase CHEMBL3047 | IC50 | 5.96 | 5.96 | 1100.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.96 | 5.96 | 1100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Transmembrane prolyl 4-hydroxylase | IC50 | = | 1100.0 | nM | 5.96 | Inhibition of prolyl 4-hydroxylase | 1312598 |
| Unchecked | IC50 | = | 1100.0 | nM | 5.96 | Inhibition of collagen prolyl 4-hydroxylase (unknown origin) | 29986141 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1312598 | 10.1021/jm00083a001 | Transmembrane prolyl 4-hydroxylase | 1 |
| 29986141 | 10.1021/acs.jmedchem.8b00822 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine