Compound Detail
CHEMBL301433
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Basic Information
| ChEMBL ID | CHEMBL301433 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VUEFSYMFLPPOHV-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
474.6
MW (Da)
6.16
ALogP
5
HBA
3
HBD
93.2
PSA (Ų)
0.23
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein farnesyltransferase CHEMBL2094108 | IC50 | 5.54 | 5.54 | 2900.0 | 1 |
| Geranylgeranyl transferase type I CHEMBL2095164 | IC50 | 5.16 | 5.16 | 7000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein farnesyltransferase | IC50 | = | 2900.0 | nM | 5.54 | Inhibition of farnesyltransferase from human Burkitt lymphoma (Daudi) cells | 11754590 |
| Geranylgeranyl transferase type I | IC50 | = | 7000.0 | nM | 5.16 | Inhibition of partially purified Geranylgeranyl transferase type I (GGTase-I) fr... | 11754590 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11754590 | 10.1021/jm0103099 | Protein farnesyltransferase | 1 |
| 11754590 | 10.1021/jm0103099 | Geranylgeranyl transferase type I | 1 |
Data from ChEMBL 36 via Core Engine