Compound Detail
CHEMBL282814
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Basic Information
| ChEMBL ID | CHEMBL282814 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UPLOQONPZIFQRI-MHZLTWQESA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
467.6
MW (Da)
5.74
ALogP
4
HBA
3
HBD
91.3
PSA (Ų)
0.29
QED
1
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Geranylgeranyl transferase type I CHEMBL2095164 | IC50 | 5.8 | 5.8 | 1600.0 | 1 |
| Protein farnesyltransferase CHEMBL2094108 | IC50 | 4.24 | 4.24 | 58000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Geranylgeranyl transferase type I | IC50 | = | 1600.0 | nM | 5.8 | In vitro inhibition of [3H]GGPP incorporation into H-Ras-CVLL by Geranylgeranyl ... | 10212118 |
| Protein farnesyltransferase | IC50 | = | 58000.0 | nM | 4.24 | In vitro inhibition of [3H]FPP incorporation into H-Ras-CVLS by Farnesyl transfe... | 10212118 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10212118 | 10.1021/jm9900873 | Protein farnesyltransferase | 2 |
| 10212118 | 10.1021/jm9900873 | Geranylgeranyl transferase type I | 1 |
| 10212118 | 10.1021/jm9900873 | Unchecked | 1 |
| 10212118 | 10.1021/jm9900873 | Protein farnesyl/geranylgeranyl transferase | 1 |
Data from ChEMBL 36 via Core Engine