Compound Detail
CHEMBL29645
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Basic Information
| ChEMBL ID | CHEMBL29645 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RAHJVTVWCZJSBE-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
428.5
MW (Da)
6.32
ALogP
4
HBA
0
HBD
44.9
PSA (Ų)
0.32
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein farnesyltransferase CHEMBL2095178 | IC50 | 8.82 | 8.39 | 1.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein farnesyltransferase | IC50 | = | 1.5 | nM | 8.82 | In vitro inhibitory activity against farnesyltransferase (FTase) | 12657284 |
| Protein farnesyltransferase | IC50 | = | 11.0 | nM | 7.96 | In vitro inhibitory activity against farnesyltransferase (FTase) | 12657284 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12657284 | 10.1016/s0960-894x(03)00096-9 | Protein farnesyltransferase | 2 |
| 12657284 | 10.1016/s0960-894x(03)00096-9 | Geranylgeranyl transferase type I | 1 |
Data from ChEMBL 36 via Core Engine