Compound Detail
CHEMBL184805
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Basic Information
| ChEMBL ID | CHEMBL184805 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZTECIVPBVZJKDW-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
430.9
MW (Da)
5.02
ALogP
6
HBA
1
HBD
84.0
PSA (Ų)
0.46
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 7.96 | 7.96 | 11.0 | 1 |
| Geranylgeranyl transferase type I CHEMBL2096987 | IC50 | 5.21 | 5.21 | 6200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 11.0 | nM | 7.96 | Inhibition of [3H]FPP incorporation into biotin-linked K-ras decapeptide (CVIM) ... | 15324873 |
| Geranylgeranyl transferase type I | IC50 | = | 6200.0 | nM | 5.21 | inhibitory concentration needed to to reduce the bovine GGTase-catalyzed incorpo... | 15324873 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15324873 | 10.1016/j.bmcl.2004.07.004 | Protein farnesyltransferase | 1 |
| 15324873 | 10.1016/j.bmcl.2004.07.004 | Unchecked | 1 |
| 15324873 | 10.1016/j.bmcl.2004.07.004 | Geranylgeranyl transferase type I | 1 |
Data from ChEMBL 36 via Core Engine