Compound Detail
CHEMBL33891
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Basic Information
| ChEMBL ID | CHEMBL33891 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KRHJDJMOIKRPNN-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
330.7
MW (Da)
4.71
ALogP
2
HBA
3
HBD
61.4
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 5.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| High affinity nerve growth factor receptor CHEMBL2815 | Ki | 5.0 | 5.0 | 10000.0 | 1 |
| Cyclin-dependent kinase 19 CHEMBL6002 | Ki | 4.7 | 4.7 | 19952.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| High affinity nerve growth factor receptor | Ki | = | 10000.0 | nM | 5.0 | PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na... | - |
| Cyclin-dependent kinase 19 | Ki | = | 19952.62 | nM | 4.7 | PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12668007 | 10.1016/s0960-894x(03)00156-2 | Calcium-activated potassium channel subunit alpha-1 | 1 |
| 12668007 | 10.1016/s0960-894x(03)00156-2 | No relevant target | 1 |
| 15615543 | 10.1021/jm030638w | Glutamate receptor ionotropic, kainate 1 | 1 |
Data from ChEMBL 36 via Core Engine