Compound Detail
CHEMBL9363
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 | CHEMBL9363 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZCRYOGHINJUGNK-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
429.4
MW (Da)
4.49
ALogP
4
HBA
2
HBD
88.2
PSA (Ų)
0.44
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.14
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 2 CHEMBL3807 | IC50 | 5.14 | 5.14 | 7260.0 | 1 |
| Tyrosine-protein phosphatase non-receptor type 1 CHEMBL335 | IC50 | 5.09 | 5.09 | 8040.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 2 | IC50 | = | 7260.0 | nM | 5.14 | Inhibitory activity against T cell protein tyrosine phosphatase | 15013020 |
| Tyrosine-protein phosphatase non-receptor type 1 | IC50 | = | 8040.0 | nM | 5.09 | Inhibitory activity against protein tyrosine phosphatase 1B (PTP1B) was determin... | 15013020 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15013020 | 10.1016/j.bmcl.2003.11.076 | Tyrosine-protein phosphatase non-receptor type 1 | 1 |
| 15013020 | 10.1016/j.bmcl.2003.11.076 | Receptor-type tyrosine-protein phosphatase C | 1 |
| 15013020 | 10.1016/j.bmcl.2003.11.076 | Tyrosine-protein phosphatase non-receptor type 2 | 1 |
| 15013020 | 10.1016/j.bmcl.2003.11.076 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine