Compound Detail
CHEMBL5523606
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Basic Information
| ChEMBL ID | CHEMBL5523606 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RLGDSKZRWANGNL-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
468.6
MW (Da)
3.55
ALogP
10
HBA
2
HBD
115.8
PSA (Ų)
0.44
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mitogen-activated protein kinase kinase kinase 14 CHEMBL5888 | IC50 | 8.3 | 7.35 | 5.0 | 3 |
| Macrophage CHEMBL5314319 | IC50 | 4.19 | 4.19 | 64100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mitogen-activated protein kinase kinase kinase 14 | IC50 | = | 5.01 | nM | 8.3 | Inhibition of NIK (unknown origin) incubated 30 to 60 mins by ADP-Glo Kinase | 38563549 |
| Mitogen-activated protein kinase kinase kinase 14 | IC50 | = | 5.01 | nM | 8.3 | Inhibition of NIK (unknown origin) incubated 30 to 60 mins by ADP-Glo Kinase ass... | 38563549 |
| Mitogen-activated protein kinase kinase kinase 14 | IC50 | = | 3560.0 | nM | 5.45 | Inhibition of NIK (unknown origin) expressed in COS-7 cells co-expressing NF-Kap... | 38563549 |
| Macrophage | IC50 | = | 64100.0 | nM | 4.19 | Anti-inflammatory activity in mouse macrophages extracted from abdominal activit... | 38563549 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38563549 | 10.1021/acs.jmedchem.3c02266 | Mitogen-activated protein kinase kinase kinase 14 | 5 |
| 38563549 | 10.1021/acs.jmedchem.3c02266 | Macrophage | 1 |
Data from ChEMBL 36 via Core Engine