Compound Detail
CHEMBL1522206
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Basic Information
| ChEMBL ID | CHEMBL1522206 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JSTSFIZUERTPFM-UHFFFAOYSA-N |
3
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
263.1
MW (Da)
3.59
ALogP
2
HBA
1
HBD
41.8
PSA (Ų)
0.73
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.55
IC50 2 meas. best 4.99
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.55 | 6.55 | 281.0 | 1 |
| Protein skinhead-1 CHEMBL2146298 | IC50 | 4.99 | 4.545 | 10300.0 | 2 |
| H4 CHEMBL1075452 | EC50 | 4.03 | 4.03 | 93820.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 281.0 | nM | 6.55 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS to Identify Activato... | - |
| Protein skinhead-1 | IC50 | = | 10300.0 | nM | 4.99 | PubChem BioAssay. Dose ResponseConfirmation of SKN-1 Inhibitor hits in a fluores... | - |
| Protein skinhead-1 | IC50 | = | 80050.0 | nM | 4.1 | PubChem BioAssay. Dose Response Confirmation of SKN-1 Inhibitor hits in a fluore... | - |
| H4 | EC50 | = | 93820.0 | nM | 4.03 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Response HTS to Identify Activato... | - |
Data from ChEMBL 36 via Core Engine