Compound Detail
CHEMBL275378
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Basic Information
| ChEMBL ID | CHEMBL275378 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GKTZPBPAMFCBNI-MSOLQXFVSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
387.6
MW (Da)
2.26
ALogP
5
HBA
2
HBD
58.8
PSA (Ų)
0.72
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein farnesyltransferase CHEMBL2094108 | IC50 | 8.52 | 8.52 | 3.0 | 2 |
| Protein farnesyltransferase CHEMBL2095197 | IC50 | 6.3 | 6.3 | 500.0 | 1 |
| Geranylgeranyl transferase type I CHEMBL2096987 | IC50 | 5.0 | 5.0 | 10000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein farnesyltransferase | IC50 | = | 3.0 | nM | 8.52 | Inhibition of [3H]FPP incorporation into Ha-Ras by Farnesyltransferase | 8691462 |
| Protein farnesyltransferase | IC50 | = | 3.0 | nM | 8.52 | Inhibition of Farnesyltransferase | 10698452 |
| Protein farnesyltransferase | IC50 | = | 500.0 | nM | 6.3 | Inhibition of post-traslational processing of Ras protein in RAT1 cell line | 8691462 |
| Geranylgeranyl transferase type I | IC50 | = | 10000.0 | nM | 5.0 | Inhibition of bovine Geranylgeranyl transferase type I | 8691462 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8691462 | 10.1021/jm9508090 | Protein farnesyltransferase | 2 |
| 8691462 | 10.1021/jm9508090 | Unchecked | 2 |
| 8691462 | 10.1021/jm9508090 | Geranylgeranyl transferase type I | 1 |
| 8691462 | 10.1021/jm9508090 | Rat1 | 1 |
| 10698452 | 10.1016/s0960-894x(99)00686-1 | Protein farnesyltransferase | 1 |
Data from ChEMBL 36 via Core Engine