Compound Detail
CHEMBL4857539
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Basic Information
| ChEMBL ID | CHEMBL4857539 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SMHIAXYYNWVQCY-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
191.3
MW (Da)
2.07
ALogP
3
HBA
2
HBD
41.6
PSA (Ų)
0.68
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.73
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| DCN1-like protein 1 CHEMBL4105838 | IC50 | 5.73 | 5.52 | 1866.6 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| DCN1-like protein 1 | IC50 | = | 1866.61 | nM | 5.73 | Inhibition of recombinant human His-tagged DCN1 (58 to 259 residues) expressed i... | 33756127 |
| DCN1-like protein 1 | IC50 | = | 4871.55 | nM | 5.31 | Inhibition of recombinant human His-tagged DCN1 (58 to 259 residues) expressed i... | 33756127 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33756127 | 10.1016/j.ejmech.2021.113326 | DCN1-like protein 1 | 2 |
Data from ChEMBL 36 via Core Engine