Compound Detail
CHEMBL4866117
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Basic Information
| ChEMBL ID | CHEMBL4866117 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YYOWSPCDQFVOGI-CMDGGOBGSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
220.3
MW (Da)
2.87
ALogP
3
HBA
2
HBD
57.5
PSA (Ų)
0.59
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.7
IC50 1 meas. best 6.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.7 | 6.7 | 200.0 | 1 |
| Islet amyloid polypeptide CHEMBL1914266 | IC50 | 6.16 | 6.16 | 700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 200.0 | nM | 6.7 | Protective activity against IAPP-induced toxicity in rat BRIN-B11 cells assessed... | 33600175 |
| Islet amyloid polypeptide | IC50 | = | 700.0 | nM | 6.16 | Inhibition of islet amyloid polypeptide (unknown origin) aggregation after 24 hr... | 33600175 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33600175 | 10.1021/acs.jnatprod.0c01162 | Unchecked | 2 |
| 33600175 | 10.1021/acs.jnatprod.0c01162 | Islet amyloid polypeptide | 1 |
Data from ChEMBL 36 via Core Engine