Compound Detail
CHEMBL69330
FARNESYL DIPHOSPHATE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL69330 |
| Name | FARNESYL DIPHOSPHATE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VWFJDQUYCIWHTN-YFVJMOTDSA-N |
4
Targets
4
Activities
2
Assay Types
0
PK Parameters
14
Publications
0
Known Names
Molecular Properties
382.3
MW (Da)
4.63
ALogP
4
HBA
3
HBD
113.3
PSA (Ų)
0.35
QED
0
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 3 meas. best 8.7
Ki 1 meas. best 5.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein farnesyltransferase CHEMBL2094108 | Kd | 8.7 | 8.7 | 2.0 | 1 |
| Farnesyltransferase CHEMBL2111393 | Kd | 7.12 | 7.12 | 75.0 | 1 |
| Squalene synthase CHEMBL3815 | Ki | 5.58 | 5.58 | 2600.0 | 1 |
| Unchecked CHEMBL612545 | Kd | 4.46 | 4.46 | 35000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein farnesyltransferase | Kd | = | 2.0 | nM | 8.7 | Binding affinity to FTase (unknown origin) | 25530833 |
| Farnesyltransferase | Kd | = | 75.0 | nM | 7.12 | Inhibition of yeast Farnesyl transferase | - |
| Squalene synthase | Ki | = | 2600.0 | nM | 5.58 | Inhibitory activity against microsomal Squalene synthase | 2061928 |
| Unchecked | Kd | = | 35000.0 | nM | 4.46 | Binding affinity to Staphylococcus aureus HepPPS | 30730737 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17371809 | 10.1128/aac.01454-06 | Unchecked | 12 |
| 15341963 | 10.1016/j.bmcl.2004.07.017 | Protein farnesyltransferase | 3 |
| - | 10.1016/S0960-894X(97)00373-9 | Farnesyltransferase | 2 |
| 2061928 | 10.1021/jm00110a024 | Squalene synthase | 2 |
| 17371809 | 10.1128/aac.01454-06 | Squalene synthase | 2 |
| 15080995 | 10.1016/j.bmcl.2004.02.077 | Farnesyltransferase | 1 |
| - | 10.1016/S0960-894X(97)10133-0 | Squalene synthase | 1 |
| 10937743 | 10.1016/s0960-894x(00)00337-1 | Protein farnesyltransferase | 1 |
| 17535895 | 10.1073/pnas.0702254104 | Geranylgeranyl pyrophosphate synthase BTS1 | 1 |
| 17535895 | 10.1073/pnas.0702254104 | Geranylgeranyl pyrophosphate synthase | 1 |
| 25530833 | 10.1039/c2md20299a | Protein farnesyltransferase | 1 |
| 189031 | 10.1021/jm00212a011 | Squalene synthase ERG9 | 1 |
| 27342751 | 10.1016/j.bmcl.2016.06.035 | Protein farnesyltransferase | 1 |
| 30730737 | 10.1021/acs.jmedchem.8b01878 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine