Compound Detail
CHEMBL3545076
LY-2584702 Phase I
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Phase I
Basic Information
| ChEMBL ID | CHEMBL3545076 |
| Name | LY-2584702 |
| Phase | Phase I |
| Structure Type | MOL |
| InChI Key | FYXRSVDHGLUMHB-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
20
Publications
3
Known Names
5
Indications
1
Mechanisms
Molecular Properties
445.4
MW (Da)
4.30
ALogP
6
HBA
1
HBD
75.5
PSA (Ų)
0.48
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Ribosomal protein S6 kinase 1 inhibitor | INHIBITOR | Ribosomal protein S6 kinase beta-1 | ✓ | ✓ |
Indications
Carcinoma, Non-Small-Cell Lung Carcinoma, Renal Cell Neoplasm Metastasis Neoplasms Neuroendocrine Tumors
Activity Summary
IC50 1 meas. best 8.4
Kd 1 meas. best 7.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ribosomal protein S6 kinase beta-1 CHEMBL4501 | IC50 | 8.4 | 8.4 | 4.0 | 1 |
| Ribosomal protein S6 kinase beta-1 CHEMBL4501 | Kd | 7.82 | 7.82 | 15.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ribosomal protein S6 kinase beta-1 | IC50 | = | 4.0 | nM | 8.4 | Inhibition of human p70S6K measured at apparent ATP Km level | 29655979 |
| Ribosomal protein S6 kinase beta-1 | Kd | = | 15.0 | nM | 7.82 | Kinobeads (epsilon), multiple immobilized ATP-competitive broad spectrum kinase ... | 29191878 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29191878 | 10.1126/science.aan4368 | Unchecked | 5 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| 29191878 | 10.1126/science.aan4368 | Actin-related protein 3 | 1 |
| 29191878 | 10.1126/science.aan4368 | Adenylate kinase 2, mitochondrial | 1 |
| 29191878 | 10.1126/science.aan4368 | Beta-adrenergic receptor kinase 1 | 1 |
| 29191878 | 10.1126/science.aan4368 | Atypical kinase COQ8A, mitochondrial | 1 |
| 29191878 | 10.1126/science.aan4368 | AarF domain-containing protein kinase 1 | 1 |
| 29191878 | 10.1126/science.aan4368 | Activin receptor type-2B | 1 |
| 29191878 | 10.1126/science.aan4368 | Activin receptor type-1B | 1 |
| 29191878 | 10.1126/science.aan4368 | Activin receptor type-1 | 1 |
| 29191878 | 10.1126/science.aan4368 | AP2-associated protein kinase 1 | 1 |
| 34481987 | 10.1016/j.bmcl.2021.128352 | Voltage-gated inwardly rectifying potassium channel KCNH2 | 1 |
| 29191878 | 10.1126/science.aan4368 | Long-chain-fatty-acid--CoA ligase 5 | 1 |
| 29191878 | 10.1126/science.aan4368 | Peroxisomal acyl-coenzyme A oxidase 3 | 1 |
| 29191878 | 10.1126/science.aan4368 | Peroxisomal acyl-coenzyme A oxidase 1 | 1 |
| 29191878 | 10.1126/science.aan4368 | Very long-chain specific acyl-CoA dehydrogenase, mitochondrial | 1 |
| 29191878 | 10.1126/science.aan4368 | Acyl-CoA dehydrogenase family member 11 | 1 |
| 29191878 | 10.1126/science.aan4368 | Acyl-CoA dehydrogenase family member 10 | 1 |
| 29191878 | 10.1126/science.aan4368 | Tyrosine-protein kinase ABL2 | 1 |
Data from ChEMBL 36 via Core Engine