Compound Detail
CHEMBL5199694
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Basic Information
| ChEMBL ID | CHEMBL5199694 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MVYAWUKJQKIZFY-VFLRZCOOSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
360.4
MW (Da)
3.09
ALogP
6
HBA
2
HBD
100.9
PSA (Ų)
0.59
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| MAP kinase-interacting serine/threonine-protein kinase 2 CHEMBL4204 | IC50 | 5.89 | 5.89 | 1300.0 | 1 |
| MAP kinase-interacting serine/threonine-protein kinase 1 CHEMBL4718 | IC50 | 5.05 | 5.05 | 8900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| MAP kinase-interacting serine/threonine-protein kinase 2 | IC50 | = | 1300.0 | nM | 5.89 | Inhibition of GST-tagged MNK2 (unknown origin) expressed in Escherichia coli BL2... | 33892273 |
| MAP kinase-interacting serine/threonine-protein kinase 1 | IC50 | = | 8900.0 | nM | 5.05 | Inhibition of GST-tagged MNK1 (unknown origin) expressed in Escherichia coli BL2... | 33892273 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33892273 | 10.1016/j.ejmech.2021.113420 | MAP kinase-interacting serine/threonine-protein kinase 1 | 1 |
| 33892273 | 10.1016/j.ejmech.2021.113420 | MAP kinase-interacting serine/threonine-protein kinase 2 | 1 |
Data from ChEMBL 36 via Core Engine