Compound Detail
CHEMBL1370927
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Basic Information
| ChEMBL ID | CHEMBL1370927 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FDNAQCWUERCJBK-UHFFFAOYSA-N |
4
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
202.2
MW (Da)
1.15
ALogP
3
HBA
3
HBD
75.3
PSA (Ų)
0.37
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.8
EC50 1 meas. best 4.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Nuclear receptor coactivator 3 CHEMBL1615382 | IC50 | 5.8 | 5.8 | 1575.0 | 1 |
| Nuclear receptor coactivator 1 CHEMBL1615387 | IC50 | 5.15 | 5.15 | 7017.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 4.92 | 4.92 | 11890.0 | 1 |
| Tegument protein VP16 CHEMBL4218 | IC50 | 4.74 | 4.74 | 18411.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Nuclear receptor coactivator 3 | IC50 | = | 1575.0 | nM | 5.8 | PUBCHEM_BIOASSAY: Counterscreen for inhibitors of the Steroid Receptor Coactivat... | - |
| Nuclear receptor coactivator 1 | IC50 | = | 7017.0 | nM | 5.15 | PUBCHEM_BIOASSAY: Luminescence-based cell-based high throughput dose response as... | - |
| Unchecked | EC50 | = | 11890.0 | nM | 4.92 | PUBCHEM_BIOASSAY: A cytotoxicity screen of small molecule inhibitors of the PhoP... | - |
| Tegument protein VP16 | IC50 | = | 18411.0 | nM | 4.74 | PUBCHEM_BIOASSAY: Counterscreen for inhibitors of the Steroid Receptor Coactivat... | - |
Data from ChEMBL 36 via Core Engine