Compound Detail
CHEMBL1467760
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Basic Information
| ChEMBL ID | CHEMBL1467760 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PBBZQGGDDNSZDP-UHFFFAOYSA-N |
4
Targets
6
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
310.2
MW (Da)
4.42
ALogP
2
HBA
0
HBD
22.0
PSA (Ų)
0.59
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.47
EC50 2 meas. best 5.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.47 | 5.935 | 340.0 | 2 |
| Mitochondrial import inner membrane translocase subunit TIM23 CHEMBL1741180 | IC50 | 5.43 | 5.43 | 3700.0 | 1 |
| Unchecked CHEMBL612545 | EC50 | 5.15 | 5.15 | 7150.0 | 1 |
| Protein RecA CHEMBL1741171 | EC50 | 5.13 | 5.13 | 7320.0 | 1 |
| Mitochondrial import inner membrane translocase subunit TIM10 CHEMBL1741194 | IC50 | 4.96 | 4.96 | 11000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 340.0 | nM | 6.47 | PUBCHEM_BIOASSAY: High Throughput Screening Assay used to Identify Novel Compoun... | - |
| Mitochondrial import inner membrane translocase subunit TIM23 | IC50 | = | 3700.0 | nM | 5.43 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS small molecule inhibitors o... | - |
| Unchecked | IC50 | = | 3950.0 | nM | 5.4 | PUBCHEM_BIOASSAY: A High Throughput Confirmatory Assay used to Identify Novel Co... | - |
| Unchecked | EC50 | = | 7150.0 | nM | 5.15 | PUBCHEM_BIOASSAY: Dose response confirmation of small molecule activators of the... | - |
| Protein RecA | EC50 | = | 7320.0 | nM | 5.13 | PUBCHEM_BIOASSAY: Fluorescence Cell-Free Homogeneous Dose Retest to Identify Inh... | - |
| Mitochondrial import inner membrane translocase subunit TIM10 | IC50 | = | 11000.0 | nM | 4.96 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS small molecule inhibitors o... | - |
Data from ChEMBL 36 via Core Engine