Compound Detail
CHEMBL101423
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Basic Information
| ChEMBL ID | CHEMBL101423 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YHXHHGDUANVQHE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
249.1
MW (Da)
3.42
ALogP
1
HBA
0
HBD
17.1
PSA (Ų)
0.59
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 1 CHEMBL335 | Ki | 4.6 | 4.6 | 25000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein phosphatase non-receptor type 1 | Ki | = | 25000.0 | nM | 4.6 | Dissociation constant towards Protein-tyrosine phosphatase 1B receptor-inhibitor... | 12372498 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12372498 | 10.1016/s0960-894x(02)00681-9 | Tyrosine-protein phosphatase non-receptor type 1 | 3 |
| - | 10.1016/j.jscs.2011.12.003 | Achaea janata | 1 |
Data from ChEMBL 36 via Core Engine