Compound Detail
CHEMBL1595221
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Basic Information
| ChEMBL ID | CHEMBL1595221 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PEDMWZNWSVYTRY-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
446.5
MW (Da)
4.59
ALogP
7
HBA
1
HBD
85.0
PSA (Ų)
0.45
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.93
IC50 1 meas. best 5.94
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Induced myeloid leukemia cell differentiation protein Mcl-1 CHEMBL4361 | IC50 | 5.94 | 5.94 | 1158.5 | 1 |
| Large ribosomal subunit protein eL19A CHEMBL1741172 | EC50 | 4.93 | 4.93 | 11790.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Induced myeloid leukemia cell differentiation protein Mcl-1 | IC50 | = | 1158.53 | nM | 5.94 | PUBCHEM_BIOASSAY: Dose Response Confirmation for Mcl-1/Noxa Interaction Inhibito... | - |
| Large ribosomal subunit protein eL19A | EC50 | = | 11790.0 | nM | 4.93 | PUBCHEM_BIOASSAY: Dose Response of TOR pathway GFP-fusion proteins in Saccharomy... | - |
Data from ChEMBL 36 via Core Engine