Compound Detail
CHEMBL350566
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Basic Information
| ChEMBL ID | CHEMBL350566 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KJOXPCYQYCFTOG-DEOSSOPVSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
444.6
MW (Da)
4.39
ALogP
4
HBA
2
HBD
79.3
PSA (Ų)
0.53
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.0
IC50 1 meas. best 8.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein farnesyltransferase CHEMBL2094108 | IC50 | 8.57 | 8.57 | 2.7 | 1 |
| NIH3T3 CHEMBL614822 | EC50 | 6.0 | 6.0 | 1000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein farnesyltransferase | IC50 | = | 2.7 | nM | 8.57 | Inhibitory activity against farnesyltransferase (FT) using SPA assay | 10201832 |
| NIH3T3 | EC50 | = | 1000.0 | nM | 6.0 | Inhibition of H-ras processing in subconfluent H-Ras-transformed NIH3T3 cells | 10201832 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10201832 | 10.1016/s0960-894x(99)00080-3 | Protein farnesyltransferase | 1 |
| 10201832 | 10.1016/s0960-894x(99)00080-3 | NIH3T3 | 1 |
Data from ChEMBL 36 via Core Engine