Compound Detail
CHEMBL3740962
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Basic Information
| ChEMBL ID | CHEMBL3740962 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SWAUPVBFZRAFSM-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
369.4
MW (Da)
5.45
ALogP
3
HBA
3
HBD
69.6
PSA (Ų)
0.44
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| CAAX prenyl protease 2 CHEMBL3411 | IC50 | 5.38 | 5.38 | 4200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| CAAX prenyl protease 2 | IC50 | = | 4200.0 | nM | 5.38 | Inhibition of human Rce1-mediated CaaX protease activity using ABZ-KSKTKC(farnes... | 26706114 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26706114 | 10.1016/j.bmc.2015.11.043 | CAAX prenyl protease 2 | 2 |
| 26706114 | 10.1016/j.bmc.2015.11.043 | ADMET | 1 |
| 26706114 | 10.1016/j.bmc.2015.11.043 | CAAX prenyl protease 1 homolog | 1 |
Data from ChEMBL 36 via Core Engine