Compound Detail
CHEMBL1476017
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Basic Information
| ChEMBL ID | CHEMBL1476017 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DZXJKBGGMPENFM-UHFFFAOYSA-N |
2
Targets
4
Activities
3
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
366.4
MW (Da)
3.78
ALogP
9
HBA
0
HBD
82.5
PSA (Ų)
0.45
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.11
EC50 1 meas. best 5.03
Kd 1 meas. best 5.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.11 | 5.7 | 780.0 | 2 |
| Phosphatidylinositol 5-phosphate 4-kinase type-2 gamma CHEMBL1770034 | Kd | 5.55 | 5.55 | 2820.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 5.03 | 5.03 | 9260.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 780.0 | nM | 6.11 | PUBCHEM_BIOASSAY: High Throughput Screening Assay used to Identify Novel Compoun... | - |
| Phosphatidylinositol 5-phosphate 4-kinase type-2 gamma | Kd | = | 2820.0 | nM | 5.55 | Inhibition of PIP5K2C (unknown origin) | - |
| Unchecked | IC50 | = | 5110.0 | nM | 5.29 | PUBCHEM_BIOASSAY: A High Throughput Confirmatory Assay used to Identify Novel Co... | - |
| Unchecked | EC50 | = | 9260.0 | nM | 5.03 | PUBCHEM_BIOASSAY: Dose response confirmation of small molecule activators of the... | - |
Data from ChEMBL 36 via Core Engine