Compound Detail
CHEMBL1532412
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Basic Information
| ChEMBL ID | CHEMBL1532412 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OOONRJPGQZXAQI-AQTBWJFISA-N |
4
Targets
6
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
374.5
MW (Da)
5.26
ALogP
4
HBA
1
HBD
64.9
PSA (Ų)
0.57
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 5.4
IC50 2 meas. best 6.31
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.31 | 6.31 | 488.0 | 1 |
| G-protein coupled receptor 35 CHEMBL1293267 | IC50 | 5.92 | 5.92 | 1191.2 | 1 |
| RNA-binding protein pos-1 CHEMBL1293304 | EC50 | 5.4 | 5.4 | 3956.0 | 1 |
| Zinc finger protein mex-5 CHEMBL1293319 | EC50 | 5.09 | 5.09 | 8128.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 4.96 | 4.955 | 11089.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 488.0 | nM | 6.31 | PUBCHEM_BIOASSAY: High Throughput Screen to Identify Inhibitors of Mycobacterium... | - |
| G-protein coupled receptor 35 | IC50 | = | 1191.15 | nM | 5.92 | PUBCHEM_BIOASSAY: Image-Based HTS for Selective Antagonists of GPR35. High conte... | - |
| RNA-binding protein pos-1 | EC50 | = | 3956.0 | nM | 5.4 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| Zinc finger protein mex-5 | EC50 | = | 8128.0 | nM | 5.09 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| Unchecked | EC50 | = | 11089.0 | nM | 4.96 | PUBCHEM_BIOASSAY: High Throughput Screen to Identify Compounds that Suppress the... | - |
| Unchecked | EC50 | = | 11250.0 | nM | 4.95 | PUBCHEM_BIOASSAY: High Throughput Screen to Identify Compounds that Suppress the... | - |
Data from ChEMBL 36 via Core Engine