Compound Detail
CHEMBL3234237
JNJ-37822681 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL3234237 |
| Name | JNJ-37822681 |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | UVUYWJWYRLJHEN-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
8
Publications
1
Known Names
1
Indications
1
Mechanisms
Molecular Properties
372.3
MW (Da)
3.85
ALogP
4
HBA
1
HBD
41.0
PSA (Ų)
0.83
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Dopamine D2 receptor antagonist | ANTAGONIST | D(2) dopamine receptor | ✓ | ✓ |
Indications
Schizophrenia
Activity Summary
Ki 2 meas. best 6.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(2) dopamine receptor CHEMBL217 | Ki | 6.8 | 6.8 | 158.0 | 1 |
| D(3) dopamine receptor CHEMBL234 | Ki | 5.94 | 5.94 | 1159.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(2) dopamine receptor | Ki | = | 158.0 | nM | 6.8 | Displacement of [3H]methylspiperone from human D2L receptor expressed in HEK cel... | 24666157 |
| D(3) dopamine receptor | Ki | = | 1159.0 | nM | 5.94 | Displacement of [3H]methylspiperone from human D3 receptor expressed in HEK293 c... | 24666157 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4651402 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| 24666157 | 10.1021/jm500126s | D(2) dopamine receptor | 1 |
| 24666157 | 10.1021/jm500126s | D(3) dopamine receptor | 1 |
| 24666157 | 10.1021/jm500126s | Unchecked | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine