Compound Detail
CHEMBL1309068
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Basic Information
| ChEMBL ID | CHEMBL1309068 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LLKOIOPUDUDOFR-FJGPGAONSA-N |
5
Targets
6
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
342.4
MW (Da)
3.20
ALogP
5
HBA
0
HBD
69.7
PSA (Ų)
0.63
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 5.42
IC50 3 meas. best 4.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Zinc finger protein mex-5 CHEMBL1293319 | EC50 | 5.42 | 5.42 | 3831.0 | 1 |
| RNA-binding protein pos-1 CHEMBL1293304 | EC50 | 5.26 | 5.26 | 5463.0 | 1 |
| Perilipin-1/ABHD5 CHEMBL3883313 | IC50 | 4.96 | 4.96 | 11043.0 | 1 |
| 1-acylglycerol-3-phosphate O-acyltransferase ABHD5/Perilipin-5 CHEMBL3885501 | IC50 | 4.76 | 4.76 | 17555.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.71 | 4.71 | 19400.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 4.33 | 4.33 | 46800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Zinc finger protein mex-5 | EC50 | = | 3831.0 | nM | 5.42 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| RNA-binding protein pos-1 | EC50 | = | 5463.0 | nM | 5.26 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| Perilipin-1/ABHD5 | IC50 | = | 11043.0 | nM | 4.96 | PUBCHEM_BIOASSAY: Luminescence-based biochemical high throughput dose response a... | - |
| 1-acylglycerol-3-phosphate O-acyltransferase ABHD5/Perilipin-5 | IC50 | = | 17555.0 | nM | 4.76 | PUBCHEM_BIOASSAY: Luminescence-based biochemical high throughput dose response a... | - |
| Unchecked | IC50 | = | 19400.0 | nM | 4.71 | PUBCHEM_BIOASSAY: Counterscreen for IDE inhibitors: Luminescence-based cell-base... | - |
| Unchecked | EC50 | = | 46800.0 | nM | 4.33 | PUBCHEM_BIOASSAY: Dose response confirmation of small molecule activators of the... | - |
Data from ChEMBL 36 via Core Engine