Compound Detail
CHEMBL4783289
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Basic Information
| ChEMBL ID | CHEMBL4783289 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NKVYDBNTELEPBO-NSHDSACASA-N |
2
Targets
3
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
375.5
MW (Da)
3.59
ALogP
8
HBA
0
HBD
73.8
PSA (Ų)
0.48
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.52
Ki 1 meas. best 7.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 8.52 | 8.52 | 3.0 | 1 |
| Hepatocyte growth factor receptor CHEMBL3717 | Ki | 7.82 | 7.82 | 15.0 | 1 |
| cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A CHEMBL241 | IC50 | 7.0 | 7.0 | 100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 3.0 | nM | 8.52 | Inhibition of c-MET in human SNU-5 cells measured after 6 hrs by steady-glo luci... | 34141080 |
| Hepatocyte growth factor receptor | Ki | = | 15.0 | nM | 7.82 | Inhibition of c-Met (unknown origin) using poly Glu-Tyr as substrate preincubate... | 34141080 |
| cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A | IC50 | = | 100.0 | nM | 7.0 | Inhibition of recombinant human N-terminal GST/His-tagged PDE3A (669 to 1141 res... | 34141080 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34141080 | 10.1021/acsmedchemlett.1c00094 | Hepatocyte growth factor receptor | 2 |
| 34141080 | 10.1021/acsmedchemlett.1c00094 | cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A | 1 |
| 34141080 | 10.1021/acsmedchemlett.1c00094 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine