Compound Detail
CHEMBL1594943
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1594943 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JLZDKNJXWPLGFL-UHFFFAOYSA-N |
5
Targets
5
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
380.4
MW (Da)
3.99
ALogP
5
HBA
1
HBD
58.6
PSA (Ų)
0.58
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 5.32
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.32 | 5.32 | 4770.0 | 1 |
| Sentrin-specific protease 7 CHEMBL1741213 | IC50 | 5.31 | 5.31 | 4900.0 | 1 |
| Sentrin-specific protease 6 CHEMBL1741215 | IC50 | 4.89 | 4.89 | 12800.0 | 1 |
| Sentrin-specific protease 8 CHEMBL1741207 | IC50 | 4.75 | 4.75 | 17800.0 | 1 |
| Caspase-3 CHEMBL2334 | IC50 | 4.55 | 4.55 | 28200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 4770.0 | nM | 5.32 | PUBCHEM_BIOASSAY: A Cell Based HTS Approach for the Discovery of New Inhibitors ... | - |
| Sentrin-specific protease 7 | IC50 | = | 4900.0 | nM | 5.31 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS for inhibitors of Sentrin-s... | - |
| Sentrin-specific protease 6 | IC50 | = | 12800.0 | nM | 4.89 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS for inhibitors of Sentrin-s... | - |
| Sentrin-specific protease 8 | IC50 | = | 17800.0 | nM | 4.75 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS for inhibitors of Sentrin-s... | - |
| Caspase-3 | IC50 | = | 28200.0 | nM | 4.55 | PUBCHEM_BIOASSAY: Dose Response confirmation of inhibitors of Sentrin-specific p... | - |
Data from ChEMBL 36 via Core Engine