Compound Detail
CHEMBL55791
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Basic Information
| ChEMBL ID | CHEMBL55791 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WVZFFIZCUQZVND-DYTRJAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
310.8
MW (Da)
4.65
ALogP
2
HBA
0
HBD
17.3
PSA (Ų)
0.67
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily A member 3 CHEMBL4633 | IC50 | 6.26 | 5.88 | 544.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily A member 3 | IC50 | = | 544.0 | nM | 6.26 | Concentration inhibiting [125I]ChTX (charybdotoxin) binding to N-type potassium ... | 7540207 |
| Potassium voltage-gated channel subfamily A member 3 | IC50 | = | 3160.0 | nM | 5.5 | Inhibition of outward potassium currents (IKn) in human T-lymphocyte N-type pota... | 7540207 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7540207 | 10.1021/jm00011a007 | Potassium voltage-gated channel subfamily A member 3 | 2 |
Data from ChEMBL 36 via Core Engine