Compound Detail
CHEMBL26501
RO-320432 Enter ChEMBL ID:
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CN(C)C[C@H]1CCn2c(c(C3=C(c4cn(C)c5ccccc45)C(=O)NC3=O)c3ccccc32)C1
Basic Information
| ChEMBL ID | CHEMBL26501 |
| Name | RO-320432 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FXGHOAZJQNLNFD-KRWDZBQOSA-N |
9
Targets
11
Activities
1
Assay Types
0
PK Parameters
10
Publications
1
Known Names
Molecular Properties
452.6
MW (Da)
3.82
ALogP
5
HBA
1
HBD
59.3
PSA (Ų)
0.48
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 11 meas. best 8.06
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein kinase C alpha type CHEMBL2855 | IC50 | 8.06 | 8.06 | 8.8 | 1 |
| Protein kinase C (PKC) CHEMBL2093867 | IC50 | 7.76 | 7.76 | 17.2 | 1 |
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 7.7 | 7.7 | 20.0 | 1 |
| Protein kinase C (PKC) CHEMBL2094266 | IC50 | 7.68 | 7.68 | 21.0 | 1 |
| Protein kinase C alpha type CHEMBL299 | IC50 | 7.66 | 7.66 | 22.0 | 1 |
| Protein kinase C beta type CHEMBL3020 | IC50 | 7.55 | 7.535 | 28.0 | 2 |
| Protein kinase C gamma type CHEMBL3604 | IC50 | 7.44 | 7.44 | 36.5 | 1 |
| Protein kinase C epsilon type CHEMBL3424 | IC50 | 6.98 | 6.98 | 105.0 | 1 |
| Phosphorylase kinase CHEMBL2111324 | IC50 | 4.81 | 4.81 | 15625.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein kinase C alpha type | IC50 | = | 8.8 | nM | 8.06 | Inhibition of Protein kinase C alpha | - |
| Protein kinase C (PKC) | IC50 | = | 17.2 | nM | 7.76 | Inhibition of protein kinase C (PKC) | - |
| Glycogen synthase kinase-3 beta | IC50 | = | 20.0 | nM | 7.7 | Inhibition of human recombinant GSK3-beta assessed as [gamma33]ATP transfer to b... | 20138512 |
| Protein kinase C (PKC) | IC50 | = | 21.0 | nM | 7.68 | Inhibition of protein kinase C from rat brain (PKC) | - |
| Protein kinase C alpha type | IC50 | = | 22.0 | nM | 7.66 | Inhibition of PKCalpha | 20138512 |
| Protein kinase C beta type | IC50 | = | 28.0 | nM | 7.55 | Inhibition of Protein kinase C beta 1 | - |
| Protein kinase C beta type | IC50 | = | 30.5 | nM | 7.52 | Inhibition of Protein kinase C beta | - |
| Protein kinase C gamma type | IC50 | = | 36.5 | nM | 7.44 | Inhibition of Protein kinase C gamma (PKC) | - |
| Protein kinase C epsilon type | IC50 | = | 105.0 | nM | 6.98 | Inhibition of Protein kinase C epsilon | - |
| Phosphorylase kinase | IC50 | = | 15625.0 | nM | 4.81 | Inhibition of phosphorylase kinase (PhK) | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)80349-8 | Protein kinase C (PKC) | 2 |
| - | 10.1016/S0960-894X(01)80349-8 | Protein kinase C beta type | 2 |
| 18328716 | 10.1016/j.bmc.2008.02.054 | Tyrosine-protein kinase SYK | 2 |
| - | 10.1016/S0960-894X(01)80349-8 | cAMP-dependent protein kinase (PKA) | 1 |
| - | 10.1016/S0960-894X(01)80349-8 | Phosphorylase kinase | 1 |
| - | 10.1016/S0960-894X(01)80349-8 | Protein kinase C alpha type | 1 |
| - | 10.1016/S0960-894X(01)80349-8 | Protein kinase C gamma type | 1 |
| - | 10.1016/S0960-894X(01)80349-8 | Protein kinase C epsilon type | 1 |
| 20138512 | 10.1016/j.bmcl.2010.01.038 | Glycogen synthase kinase-3 beta | 1 |
| 20138512 | 10.1016/j.bmcl.2010.01.038 | Protein kinase C alpha type | 1 |
Data from ChEMBL 36 via Core Engine