Compound Detail
CHEMBL426658
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Basic Information
| ChEMBL ID | CHEMBL426658 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OEIWNDGDGDPXIO-UHFFFAOYSA-N |
1
Targets
5
Activities
1
Assay Types
2
PK Parameters
3
Publications
0
Known Names
Molecular Properties
328.8
MW (Da)
3.64
ALogP
5
HBA
1
HBD
51.5
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 7.32
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase pim-1 CHEMBL2147 | IC50 | 7.32 | 7.32 | 48.0 | 5 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 9.12 | mL.min-1.g-1 | Homo sapiens |
| CL | 14.79 | uL.min-1.(10^6cells)-1 | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase pim-1 | IC50 | = | 48.0 | nM | 7.32 | Kinase-Glo Assay: These assays are set up in duplicate 50 ul volumes in white, f... | - |
| Serine/threonine-protein kinase pim-1 | IC50 | = | 48.0 | nM | 7.32 | Kinase-Glo Assay: These assays are set up in duplicate 50 ul volumes in white, f... | - |
| Serine/threonine-protein kinase pim-1 | IC50 | = | 48.0 | nM | 7.32 | Pim-1 Kinase Inhibition Assay: One illustrative manner in which Pim-1 kinase act... | - |
| Serine/threonine-protein kinase pim-1 | IC50 | = | 48.0 | nM | 7.32 | Kinase Inhibition Assay: One illustrative manner in which Pim-1 kinase activity ... | - |
| Serine/threonine-protein kinase pim-1 | IC50 | = | 48.0 | nM | 7.32 | Pim-1 Kinase Inhibition Assay: One illustrative manner in which Pim-1 kinase act... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL3301361 | ADMET | 3 |
| 16302800 | 10.1021/jm0504858 | Serine/threonine-protein kinase pim-1 | 2 |
| - | 10.6019/CHEMBL3301361 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine