Compound Detail
CHEMBL1369296
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Basic Information
| ChEMBL ID | CHEMBL1369296 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GUVWKXLQBOLHOI-ZROIWOOFSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
299.7
MW (Da)
3.39
ALogP
4
HBA
1
HBD
58.9
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.64
EC50 1 meas. best 5.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Perilipin-1/ABHD5 CHEMBL3883313 | IC50 | 5.64 | 5.64 | 2278.0 | 1 |
| 1-acylglycerol-3-phosphate O-acyltransferase ABHD5/Perilipin-5 CHEMBL3885501 | IC50 | 5.51 | 5.51 | 3103.0 | 1 |
| Neurotensin receptor type 1 CHEMBL4123 | EC50 | 5.08 | 5.08 | 8290.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Perilipin-1/ABHD5 | IC50 | = | 2278.0 | nM | 5.64 | PUBCHEM_BIOASSAY: Luminescence-based biochemical high throughput dose response a... | - |
| 1-acylglycerol-3-phosphate O-acyltransferase ABHD5/Perilipin-5 | IC50 | = | 3103.0 | nM | 5.51 | PUBCHEM_BIOASSAY: Luminescence-based biochemical high throughput dose response a... | - |
| Neurotensin receptor type 1 | EC50 | = | 8290.0 | nM | 5.08 | PUBCHEM_BIOASSAY: Dose Response confirmation of Image-Based HTS for Selective Ag... | - |
Data from ChEMBL 36 via Core Engine