Compound Detail
CHEMBL1327810
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Basic Information
| ChEMBL ID | CHEMBL1327810 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HBZPNOOQJXGFBR-UHFFFAOYSA-N |
6
Targets
7
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
295.3
MW (Da)
3.11
ALogP
6
HBA
0
HBD
78.1
PSA (Ų)
0.54
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 5 meas. best 6.36
IC50 2 meas. best 4.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.36 | 6.36 | 435.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 5.37 | 5.37 | 4304.0 | 1 |
| Luciferin 4-monooxygenase CHEMBL5567 | EC50 | 5.36 | 5.36 | 4331.0 | 1 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 5.12 | 5.12 | 7508.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 5.04 | 5.04 | 9166.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.54 | 4.54 | 28818.0 | 1 |
| Mitochondrial import inner membrane translocase subunit TIM10 CHEMBL1741194 | IC50 | 4.36 | 4.36 | 43400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 435.0 | nM | 6.36 | PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Confirmation HTS to Identify Inhi... | - |
| Streptokinase A | EC50 | = | 4304.0 | nM | 5.37 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Luciferin 4-monooxygenase | EC50 | = | 4331.0 | nM | 5.36 | PUBCHEM_BIOASSAY: Luminescence Biochemical Dose Response HTS to Identify Inhibit... | - |
| Streptococcus sp. 'group A' | EC50 | = | 7508.0 | nM | 5.12 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Iden... | - |
| Streptococcus | EC50 | = | 9166.0 | nM | 5.04 | PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Response HTS to Identify... | - |
| Unchecked | IC50 | = | 28818.0 | nM | 4.54 | PubChem BioAssay. Luminescence-based cell-based high throughput dose response as... | - |
| Mitochondrial import inner membrane translocase subunit TIM10 | IC50 | = | 43400.0 | nM | 4.36 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS small molecule inhibitors o... | - |
Data from ChEMBL 36 via Core Engine