Compound Detail
CHEMBL5175853
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 | CHEMBL5175853 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RIVHGLWVVDJGBM-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
352.3
MW (Da)
3.21
ALogP
5
HBA
2
HBD
81.1
PSA (Ų)
0.89
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.45
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 11 CHEMBL3864 | IC50 | 6.45 | 6.4233 | 358.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 11 | IC50 | = | 358.0 | nM | 6.45 | SHP2 Allosteric Inhibition Assay: More specifically, the phosphatase reactions w... | - |
| Tyrosine-protein phosphatase non-receptor type 11 | IC50 | = | 358.0 | nM | 6.45 | SHP2 Allosteric Inhibition Assay: More specifically, the phosphatase reactions w... | - |
| Tyrosine-protein phosphatase non-receptor type 11 | IC50 | = | 425.0 | nM | 6.37 | Allosteric inhibition of wild-type human SHP2 (1 to 535 residues) using DiFMUP a... | 35063735 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35063735 | 10.1016/j.ejmech.2022.114106 | Tyrosine-protein phosphatase non-receptor type 11 | 4 |
Data from ChEMBL 36 via Core Engine