Compound Detail
CHEMBL3623896
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL3623896 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JRUJPWQYJMOGKB-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
396.4
MW (Da)
3.79
ALogP
6
HBA
1
HBD
93.5
PSA (Ų)
0.55
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 9.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein-serine O-palmitoleoyltransferase porcupine CHEMBL1255163 | IC50 | 9.42 | 9.33 | 0.4 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein-serine O-palmitoleoyltransferase porcupine | IC50 | = | 0.38 | nM | 9.42 | Inhibition of porcupine (unknown origin) | 26455655 |
| Protein-serine O-palmitoleoyltransferase porcupine | IC50 | = | 0.57 | nM | 9.24 | Inhibition of porcupine (unknown origin) expressed in mouse L Wnt3A cells co-cul... | 26455655 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26455655 | 10.1016/j.bmc.2015.09.048 | Protein-serine O-palmitoleoyltransferase porcupine | 3 |
| 26455655 | 10.1016/j.bmc.2015.09.048 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine