Compound Detail
CHEMBL1303193
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Basic Information
| ChEMBL ID | CHEMBL1303193 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VBASGZPOQCXMLJ-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
413.4
MW (Da)
5.41
ALogP
5
HBA
0
HBD
49.2
PSA (Ų)
0.39
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 6.09
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| G-protein coupled receptor 55 CHEMBL1075322 | EC50 | 6.09 | 6.09 | 807.3 | 1 |
| Unchecked CHEMBL612545 | EC50 | 5.51 | 5.51 | 3090.0 | 1 |
| Neurotensin receptor type 1 CHEMBL4123 | EC50 | 5.24 | 5.24 | 5800.0 | 1 |
| Endoribonuclease toxin MazF CHEMBL1795096 | EC50 | 4.46 | 4.46 | 34600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| G-protein coupled receptor 55 | EC50 | = | 807.29 | nM | 6.09 | PUBCHEM_BIOASSAY: Image-based HTS for Selective Agonists of GPR55. (Class of ass... | - |
| Unchecked | EC50 | = | 3090.0 | nM | 5.51 | PUBCHEM_BIOASSAY: HCS for Compounds that Up-Regulate Insulin Promoter Activity i... | - |
| Neurotensin receptor type 1 | EC50 | = | 5800.0 | nM | 5.24 | PUBCHEM_BIOASSAY: Dose Response confirmation of Image-Based HTS for Selective Ag... | - |
| Endoribonuclease toxin MazF | EC50 | = | 34600.0 | nM | 4.46 | PUBCHEM_BIOASSAY: Dose response confirmation uHTS hits for MazEF TA System activ... | - |
Data from ChEMBL 36 via Core Engine