Compound Detail
CHEMBL1565536
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Basic Information
| ChEMBL ID | CHEMBL1565536 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YAHHFWGBZGKXKT-UHFFFAOYSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
381.5
MW (Da)
3.46
ALogP
6
HBA
2
HBD
83.8
PSA (Ų)
0.62
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.71
EC50 1 meas. best 5.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily KQT member 2 CHEMBL5530 | EC50 | 5.52 | 5.52 | 3010.0 | 1 |
| Mitochondrial import inner membrane translocase subunit TIM10 CHEMBL1741194 | IC50 | 4.71 | 4.71 | 19500.0 | 1 |
| C-C chemokine receptor type 6 CHEMBL4423 | IC50 | 4.32 | 4.32 | 47400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily KQT member 2 | EC50 | = | 3010.0 | nM | 5.52 | PUBCHEM_BIOASSAY: Mode of action assay-Automated electrophysiology assay of comp... | - |
| Mitochondrial import inner membrane translocase subunit TIM10 | IC50 | = | 19500.0 | nM | 4.71 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS small molecule inhibitors o... | - |
| C-C chemokine receptor type 6 | IC50 | = | 47400.0 | nM | 4.32 | PUBCHEM_BIOASSAY: Dose Response confirmation of small molecule antagonists of th... | - |
Data from ChEMBL 36 via Core Engine