Compound Detail
CHEMBL3317688
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Basic Information
| ChEMBL ID | CHEMBL3317688 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QFKBKBDWSBQPKB-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
367.5
MW (Da)
4.38
ALogP
5
HBA
0
HBD
48.0
PSA (Ų)
0.47
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A CHEMBL4409 | IC50 | 7.4 | 7.4 | 40.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | IC50 | = | 40.0 | nM | 7.4 | Inhibition of human PDE10A (amino acids 14 to 779) using [3H]-labelled cyclic nu... | 25016376 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25016376 | 10.1016/j.ejmech.2014.07.020 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 2 |
| 25016376 | 10.1016/j.ejmech.2014.07.020 | cGMP-dependent 3',5'-cyclic phosphodiesterase | 1 |
| 25016376 | 10.1016/j.ejmech.2014.07.020 | Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C | 1 |
| 25016376 | 10.1016/j.ejmech.2014.07.020 | cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A | 1 |
| 25016376 | 10.1016/j.ejmech.2014.07.020 | 3',5'-cyclic-AMP phosphodiesterase 4D | 1 |
| 25016376 | 10.1016/j.ejmech.2014.07.020 | cGMP-specific 3',5'-cyclic phosphodiesterase | 1 |
| 25016376 | 10.1016/j.ejmech.2014.07.020 | 3',5'-cyclic-AMP phosphodiesterase 7B | 1 |
| 25016376 | 10.1016/j.ejmech.2014.07.020 | High affinity cAMP-specific and IBMX-insensitive 3',5'-cyclic phosphodiesterase 8A | 1 |
| 25016376 | 10.1016/j.ejmech.2014.07.020 | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | 1 |
| 25016376 | 10.1016/j.ejmech.2014.07.020 | Dual 3',5'-cyclic-AMP and -GMP phosphodiesterase 11A | 1 |
| 25016376 | 10.1016/j.ejmech.2014.07.020 | MDCK | 1 |
Data from ChEMBL 36 via Core Engine