Compound Detail
CHEMBL1453409
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1453409 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GJMTYCZWGYYWEG-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
349.3
MW (Da)
-0.46
ALogP
10
HBA
1
HBD
152.3
PSA (Ų)
0.43
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.06
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Induced myeloid leukemia cell differentiation protein Mcl-1 CHEMBL4361 | IC50 | 5.06 | 5.06 | 8626.0 | 1 |
| Bcl-2-like protein 1 CHEMBL4625 | IC50 | 4.67 | 4.67 | 21291.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.25 | 4.25 | 55640.0 | 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 | = | 8626.0 | nM | 5.06 | PUBCHEM_BIOASSAY: Fluorescence polarization-based biochemical high throughput do... | - |
| Bcl-2-like protein 1 | IC50 | = | 21291.0 | nM | 4.67 | PUBCHEM_BIOASSAY: Counterscreen for inhibitors of MCL1: fluorescence polarizatio... | - |
| Unchecked | IC50 | = | 55640.0 | nM | 4.25 | PubChem BioAssay. Fluorescence-based biochemical primary high throughput dose re... | - |
Data from ChEMBL 36 via Core Engine