Compound Detail
CHEMBL397434
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Basic Information
| ChEMBL ID | CHEMBL397434 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ULIQGBPQLPCTAJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
242.3
MW (Da)
2.65
ALogP
4
HBA
1
HBD
54.5
PSA (Ų)
0.57
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| CDC7/DBF4 (Cell division cycle 7-related protein kinase/Activator of S phase kinase) CHEMBL2111377 | IC50 | 6.7 | 6.7 | 200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| CDC7/DBF4 (Cell division cycle 7-related protein kinase/Activator of S phase kinase) | IC50 | = | 200.0 | nM | 6.7 | Inhibition of recombinant human CDC7/Dbf4 expressed in baculovirus infected Sf9 ... | 33139113 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33139113 | 10.1016/j.ejmech.2020.112968 | CDC7/DBF4 (Cell division cycle 7-related protein kinase/Activator of S phase kinase) | 3 |
| 14695841 | 10.1021/jm030389b | Mycobacterium tuberculosis | 3 |
| 33139113 | 10.1016/j.ejmech.2020.112968 | Unchecked | 2 |
| 33139113 | 10.1016/j.ejmech.2020.112968 | Cyclin-dependent kinase 5/CDK5 activator 1 | 2 |
| 33139113 | 10.1016/j.ejmech.2020.112968 | SH-SY5Y | 2 |
| 15689155 | 10.1021/jm0408767 | Mitogen-activated protein kinase 8 | 1 |
| - | 10.6019/CHEMBL3301361 | No relevant target | 1 |
| 17156894 | 10.1016/j.ejmech.2006.10.014 | Leishmania chagasi | 1 |
| 15689155 | 10.1021/jm0408767 | Mitogen-activated protein kinase 1 | 1 |
| 15689155 | 10.1021/jm0408767 | Mitogen-activated protein kinase 3 | 1 |
| 15689155 | 10.1021/jm0408767 | Tyrosine-protein kinase Lck | 1 |
| 15689155 | 10.1021/jm0408767 | Mitogen-activated protein kinase 10 | 1 |
| 15689155 | 10.1021/jm0408767 | Mitogen-activated protein kinase 9 | 1 |
| 15689155 | 10.1021/jm0408767 | Ca2+/calmodulin-dependent protein kinase II (CaM kinase II) | 1 |
| 15689155 | 10.1021/jm0408767 | Mitogen-activated protein kinase 14 | 1 |
| 15689155 | 10.1021/jm0408767 | Rho-associated protein kinase 1 | 1 |
| 15689155 | 10.1021/jm0408767 | Protein kinase C alpha type | 1 |
| 15689155 | 10.1021/jm0408767 | RAC-alpha serine/threonine-protein kinase | 1 |
| 15689155 | 10.1021/jm0408767 | cAMP-dependent protein kinase (PKA) | 1 |
| 15689155 | 10.1021/jm0408767 | Dual specificity mitogen-activated protein kinase kinase 1 | 1 |
Data from ChEMBL 36 via Core Engine