Compound Detail
CHEMBL3741518
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL3741518 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VWEVGRMBISXBDM-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
347.4
MW (Da)
3.58
ALogP
6
HBA
0
HBD
76.1
PSA (Ų)
0.52
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A CHEMBL4409 | IC50 | 8.77 | 8.77 | 1.7 | 1 |
| cGMP-dependent 3',5'-cyclic phosphodiesterase CHEMBL2652 | IC50 | 7.01 | 7.01 | 98.6 | 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 | = | 1.69 | nM | 8.77 | Inhibition of human recombinant PDE10A1 expressed in baculovirus infected insect... | 26562545 |
| cGMP-dependent 3',5'-cyclic phosphodiesterase | IC50 | = | 98.6 | nM | 7.01 | Inhibition of cGMP activated human recombinant PDE2A using [3H]cAMP as substrate... | 26562545 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26562545 | 10.1016/j.ejmech.2015.10.028 | cGMP-dependent 3',5'-cyclic phosphodiesterase | 1 |
| 26562545 | 10.1016/j.ejmech.2015.10.028 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 1 |
| 26562545 | 10.1016/j.ejmech.2015.10.028 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine