Compound Detail
CHEMBL2012569
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Basic Information
| ChEMBL ID | CHEMBL2012569 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VXDUTCPSYSDXLA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
283.4
MW (Da)
3.25
ALogP
4
HBA
1
HBD
53.1
PSA (Ų)
0.73
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase haspin CHEMBL1075163 | IC50 | 6.66 | 6.66 | 220.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase haspin | IC50 | = | 220.0 | nM | 6.66 | Inhibition of human recombinant N-terminal MBP-tagged haspin kinase expressed in... | 22335895 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22335895 | 10.1016/j.bmcl.2012.01.028 | Serine/threonine-protein kinase haspin | 1 |
| 22335895 | 10.1016/j.bmcl.2012.01.028 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 | 1 |
Data from ChEMBL 36 via Core Engine