Compound Detail
CHEMBL365607
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Basic Information
| ChEMBL ID | CHEMBL365607 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WIKGAEMMNQTUGL-JTQLQIEISA-N |
2
Targets
2
Activities
2
Assay Types
1
PK Parameters
3
Publications
0
Known Names
Molecular Properties
277.7
MW (Da)
1.91
ALogP
2
HBA
2
HBD
65.2
PSA (Ų)
0.82
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.64
IC50 1 meas. best 6.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Jurkat CHEMBL397 | EC50 | 6.64 | 6.64 | 230.0 | 1 |
| Receptor-interacting serine/threonine-protein kinase 1 CHEMBL5464 | IC50 | 6.5 | 6.5 | 320.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 1.0 | hr | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Jurkat | EC50 | = | 230.0 | nM | 6.64 | Effective concentration required for inhibition of necroptosis in FADD deficient... | 16153840 |
| Receptor-interacting serine/threonine-protein kinase 1 | IC50 | = | 320.0 | nM | 6.5 | Inhibition of RIPK1 (unknown origin) | 38199165 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16153840 | 10.1016/j.bmcl.2005.07.077 | Jurkat | 1 |
| 38199165 | 10.1016/j.ejmech.2024.116123 | Receptor-interacting serine/threonine-protein kinase 1 | 1 |
| 38199165 | 10.1016/j.ejmech.2024.116123 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine