Compound Detail
CHEMBL3357178
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Basic Information
| ChEMBL ID | CHEMBL3357178 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RWUPAXMLORGXTQ-NSLJXJERSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
446.5
MW (Da)
2.76
ALogP
7
HBA
2
HBD
97.3
PSA (Ų)
0.31
QED
0
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.98
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Receptor-type tyrosine-protein kinase FLT3 CHEMBL1974 | IC50 | 4.98 | 4.885 | 10520.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Receptor-type tyrosine-protein kinase FLT3 | IC50 | = | 10520.0 | nM | 4.98 | Inhibition of recombinant FLT3 D835Y mutant (unknown origin) by TR-FRET assay | 25456387 |
| Receptor-type tyrosine-protein kinase FLT3 | IC50 | = | 16220.0 | nM | 4.79 | Inhibition of recombinant FLT3 (unknown origin) by TR-FRET assay | 25456387 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25456387 | 10.1016/j.bmc.2014.10.006 | Receptor-type tyrosine-protein kinase FLT3 | 3 |
| 25456387 | 10.1016/j.bmc.2014.10.006 | MAP kinase-interacting serine/threonine-protein kinase 1 | 1 |
| 25456387 | 10.1016/j.bmc.2014.10.006 | MAP kinase-interacting serine/threonine-protein kinase 2 | 1 |
| 25456387 | 10.1016/j.bmc.2014.10.006 | MV4-11 | 1 |
Data from ChEMBL 36 via Core Engine