Compound Detail
CHEMBL5413252
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Basic Information
| ChEMBL ID | CHEMBL5413252 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XUPLVTZAFJTIQB-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
434.5
MW (Da)
3.31
ALogP
5
HBA
0
HBD
50.6
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 10.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ceramide glucosyltransferase CHEMBL2063 | EC50 | 10.0 | 10.0 | 0.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ceramide glucosyltransferase | EC50 | = | 0.1 | nM | 10.0 | Inhibition of GCS activity in human A-375 cells using C6 ceramide as substrate p... | 38116443 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38116443 | 10.1021/acsmedchemlett.3c00475 | Ceramide glucosyltransferase | 1 |
Data from ChEMBL 36 via Core Engine