Compound Detail
CHEMBL510975
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Basic Information
| ChEMBL ID | CHEMBL510975 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QRXBDPYWCAAAAI-WWHASAIZSA-N |
2
Targets
6
Activities
2
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
248.2
MW (Da)
-4.00
ALogP
7
HBA
6
HBD
148.3
PSA (Ų)
0.26
QED
1
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 5 meas. best 5.51
IC50 1 meas. best 5.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen phosphorylase, muscle form CHEMBL4696 | IC50 | 5.51 | 5.51 | 3100.0 | 1 |
| Glycogen phosphorylase, muscle form CHEMBL4696 | Ki | 5.51 | 5.51 | 3100.0 | 4 |
| Unchecked CHEMBL612545 | Ki | 5.51 | 5.51 | 3100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen phosphorylase, muscle form | IC50 | = | 3100.0 | nM | 5.51 | Binding affinity to rabbit muscular GPb by NMR binding assay | 22229710 |
| Glycogen phosphorylase, muscle form | Ki | = | 3100.0 | nM | 5.51 | Inhibition of rabbit muscle glycogen phosphorylase b | 18793852 |
| Glycogen phosphorylase, muscle form | Ki | = | 3100.0 | nM | 5.51 | Inhibition of rabbit muscle glycogen phosphorylase b | 19781947 |
| Glycogen phosphorylase, muscle form | Ki | = | 3100.0 | nM | 5.51 | Inhibition of rabbit muscle glycogen phosphorylase b assessed as inorganic phosp... | 22325154 |
| Glycogen phosphorylase, muscle form | Ki | = | 3100.0 | nM | 5.51 | Competitive inhibition of rabbit muscle glycogen phosphorylase b in presence of ... | 26708111 |
| Unchecked | Ki | = | 3100.0 | nM | 5.51 | Inhibition of rabbit muscle Glycogen phosphorylase b using glucose-1-phosphate a... | 31251604 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18793852 | 10.1016/j.bmcl.2008.08.052 | Glycogen phosphorylase, muscle form | 1 |
| 19781947 | 10.1016/j.bmc.2009.08.060 | Glycogen phosphorylase, muscle form | 1 |
| 22325154 | 10.1016/j.bmc.2011.12.059 | Glycogen phosphorylase, muscle form | 1 |
| 22229710 | 10.1021/jm201439b | Glycogen phosphorylase, muscle form | 1 |
| 26708111 | 10.1016/j.ejmech.2015.12.004 | Glycogen phosphorylase, muscle form | 1 |
| 31251604 | 10.1021/acs.jmedchem.9b00356 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine