Compound Detail
CHEMBL3926685
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Basic Information
| ChEMBL ID | CHEMBL3926685 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YKJYGUGTPDWNNH-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
2
PK Parameters
2
Publications
0
Known Names
Molecular Properties
356.4
MW (Da)
3.04
ALogP
6
HBA
1
HBD
85.6
PSA (Ų)
0.59
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 8.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein-serine O-palmitoleoyltransferase porcupine CHEMBL1255164 | EC50 | 8.05 | 8.05 | 9.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 1.667 | hr | Mus musculus |
| T1/2 | 3.333 | hr | Mus musculus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein-serine O-palmitoleoyltransferase porcupine | EC50 | = | 9.0 | nM | 8.05 | Inhibition of porcupine-mediated Wnt signaling in mouse L-cells after 24 hrs by ... | 27876319 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27876319 | 10.1016/j.bmcl.2016.11.012 | ADMET | 2 |
| 27876319 | 10.1016/j.bmcl.2016.11.012 | Protein-serine O-palmitoleoyltransferase porcupine | 1 |
Data from ChEMBL 36 via Core Engine