Compound Detail
CHEMBL5687020
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Basic Information
| ChEMBL ID | CHEMBL5687020 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CYQIJHLSMVMBKZ-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
473.6
MW (Da)
3.65
ALogP
8
HBA
1
HBD
77.1
PSA (Ų)
0.62
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.51
IC50 1 meas. best 5.61
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mitogen-activated protein kinase 7 CHEMBL5332 | IC50 | 5.61 | 5.61 | 2460.0 | 1 |
| Mitogen-activated protein kinase 7 CHEMBL5332 | EC50 | 5.51 | 5.51 | 3100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mitogen-activated protein kinase 7 | IC50 | = | 2460.0 | nM | 5.61 | Inhibition of N-terminal 6His-tagged human ERK5 expressed in baculovirus infecte... | 24239623 |
| Mitogen-activated protein kinase 7 | EC50 | = | 3100.0 | nM | 5.51 | Inhibition of EGF-stimulated ERK5 autophosphorylation in human HeLa cells preinc... | 24239623 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24239623 | 10.1016/j.ejmech.2013.10.052 | Mitogen-activated protein kinase 7 | 2 |
| 24239623 | 10.1016/j.ejmech.2013.10.052 | Leucine-rich repeat serine/threonine-protein kinase 2 | 1 |
Data from ChEMBL 36 via Core Engine