Compound Detail
CHEMBL4560122
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Basic Information
| ChEMBL ID | CHEMBL4560122 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VANQDVBFKXYNCA-UHFFFAOYSA-N |
| Parent Compound | CHEMBL4595933 |
| Active Moiety | CHEMBL4595933 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
481.2
MW (Da)
3.81
ALogP
7
HBA
1
HBD
85.2
PSA (Ų)
0.44
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.49
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Solute carrier family 22 member 12 CHEMBL6120 | IC50 | 5.49 | 5.49 | 3240.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Solute carrier family 22 member 12 | IC50 | = | 3240.0 | nM | 5.49 | Inhibition of human URAT1 expressed in HEK293 cells assessed as reduction in [8-... | 30579795 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30579795 | 10.1016/j.bmcl.2018.12.036 | Solute carrier family 22 member 12 | 1 |
Data from ChEMBL 36 via Core Engine