Compound Detail
CHEMBL75988
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Basic Information
| ChEMBL ID | CHEMBL75988 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GAQBUFAKKWTZTI-ACAGNQJTSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
463.1
MW (Da)
5.00
ALogP
3
HBA
2
HBD
66.4
PSA (Ų)
0.50
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAF proto-oncogene serine/threonine-protein kinase CHEMBL1906 | IC50 | 7.6 | 7.6 | 25.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAF proto-oncogene serine/threonine-protein kinase | IC50 | = | 25.0 | nM | 7.6 | Inhibition of cRaf1 kinase in cascade assay | 10698440 |
| RAF proto-oncogene serine/threonine-protein kinase | IC50 | = | 25.0 | nM | 7.6 | Inhibition of Raf1 kinase | 18346893 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10698440 | 10.1016/s0960-894x(99)00668-x | RAF proto-oncogene serine/threonine-protein kinase | 1 |
| 10698440 | 10.1016/s0960-894x(99)00668-x | Unchecked | 1 |
| 18346893 | 10.1016/j.bmcl.2008.02.068 | RAF proto-oncogene serine/threonine-protein kinase | 1 |
Data from ChEMBL 36 via Core Engine