Compound Detail
CHEMBL5193925
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COc1cc2c(Oc3ccc(Nc4nn(C)cc4C(=O)NC4CCCCC4)cc3F)ccnc2cc1OCCCN(C)C
Basic Information
| ChEMBL ID | CHEMBL5193925 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OUQYMPVCXDWPGK-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
590.7
MW (Da)
6.04
ALogP
9
HBA
2
HBD
102.8
PSA (Ų)
0.19
QED
2
Ro5 Violations
12
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.49
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO CHEMBL4895 | IC50 | 8.49 | 8.49 | 3.2 | 1 |
| BaF3 CHEMBL614524 | IC50 | 7.94 | 7.94 | 11.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO | IC50 | = | 3.2 | nM | 8.49 | Inhibition of recombinant AXL (unknown origin) using poly (Glu,Tyr) 4:1 as subst... | 36358010 |
| BaF3 | IC50 | = | 11.6 | nM | 7.94 | Antiproliferative activity against mouse BaF3 cells transfected with TEL-AXL ass... | 36358010 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36358010 | 10.1021/acs.jmedchem.2c01346 | Tyrosine-protein kinase receptor UFO | 1 |
| 36358010 | 10.1021/acs.jmedchem.2c01346 | BaF3 | 1 |
Data from ChEMBL 36 via Core Engine