Compound Detail
CHEMBL3098752
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 | CHEMBL3098752 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RGPYTJUGAIXXRM-UHFFFAOYSA-N |
1
Targets
5
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
325.1
MW (Da)
3.65
ALogP
3
HBA
2
HBD
79.3
PSA (Ų)
0.90
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.08
Ki 2 meas. best 6.1
Target Activity Profile
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sortilin | Ki | = | 790.0 | nM | 6.1 | hSortilin Affinity Assay: The Sortilin assay was performed in total volume of 40... | - |
| Sortilin | Ki | = | 790.0 | nM | 6.1 | hSortilin Affinity Assay: The Sortilin assay was performed in total volume of 40... | - |
| Sortilin | IC50 | = | 830.0 | nM | 6.08 | Displacement of [3H]-neurotensin from sortilin (unknown origin) incubated 30 min... | 24355129 |
| Sortilin | IC50 | = | 830.0 | nM | 6.08 | hSortilin Affinity Assay: The Sortilin assay was performed in total volume of 40... | - |
| Sortilin | IC50 | = | 830.0 | nM | 6.08 | hSortilin Affinity Assay: The Sortilin assay was performed in total volume of 40... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24355129 | 10.1016/j.bmcl.2013.11.046 | Sortilin | 1 |
Data from ChEMBL 36 via Core Engine