Compound Detail
CHEMBL5864686
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Basic Information
| ChEMBL ID | CHEMBL5864686 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OUBQQWXHNONJNU-NSHDSACASA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
479.7
MW (Da)
4.55
ALogP
5
HBA
3
HBD
87.1
PSA (Ų)
0.48
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| TGF-beta receptor type-1 CHEMBL4439 | IC50 | 6.6 | 6.6 | 250.0 | 2 |
| Activin receptor type-1B CHEMBL5310 | IC50 | 4.03 | 4.03 | 93200.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| TGF-beta receptor type-1 | IC50 | = | 250.0 | nM | 6.6 | In Vitro Kinase Assay Inhibition of ALK1/2/3/4/5/6 Kinases: Compound of the inve... | - |
| TGF-beta receptor type-1 | IC50 | = | 250.0 | nM | 6.6 | In Vitro Kinase Assay: Compound of the invention were screened in an in vitro ki... | - |
| Activin receptor type-1B | IC50 | = | 93200.0 | nM | 4.03 | In Vitro Kinase Assay Inhibition of ALK1/2/3/4/5/6 Kinases: Compound of the inve... | - |
| Activin receptor type-1B | IC50 | = | 93200.0 | nM | 4.03 | In Vitro Kinase Assay: Compound of the invention were screened in an in vitro ki... | - |
Data from ChEMBL 36 via Core Engine