Molecule Details
| InChIKey | ZKZFPRUSWCYSGT-UHFFFAOYSA-N |
|---|---|
| Compound Name | Mazapertine |
| Canonical SMILES | CC(C)Oc1ccccc1N1CCN(Cc2cccc(C(=O)N3CCCCC3)c2)CC1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 6 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.7 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB20960 |
|---|---|
| Drug Name | Mazapertine |
| CAS Number | 134208-17-6 |
| Groups | experimental |
| ATC Codes | nan |
| Description | Mazapertine is a small molecule drug. Mazapertine has a monoisotopic molecular weight of 421.27 Da. |
Cross-references: BindingDB: 50029257 CHEMBL10085
Target Activities (6)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P35348 | ADRA1A | Homo sapiens | Human | PF00001 | 9.8 | Ki | ChEMBL;BindingDB |
| P25100 | ADRA1D | Homo sapiens | Human | PF00001 | 8.9 | Ki | ChEMBL |
| P08908 | HTR1A | Homo sapiens | Human | PF00001 | 8.8 | Ki | ChEMBL;BindingDB |
| P35462 | DRD3 | Homo sapiens | Human | PF00001 | 8.7 | Ki | ChEMBL;BindingDB |
| P14416 | DRD2 | Homo sapiens | Human | PF00001 | 8.7 | Ki | ChEMBL;BindingDB |
| P35368 | ADRA1B | Homo sapiens | Human | PF00001 | 7.3 | Ki | ChEMBL;BindingDB |
DrugBank Target Actions (10)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P08908 | HTR1A | 5-hydroxytryptamine receptor 1A | inhibitor | targets |
| P08913 | ADRA2A | Alpha-2A adrenergic receptor | inhibitor | targets |
| P14416 | DRD2 | D(2) dopamine receptor | inhibitor | targets |
| P18089 | ADRA2B | Alpha-2B adrenergic receptor | inhibitor | targets |
| P18825 | ADRA2C | Alpha-2C adrenergic receptor | inhibitor | targets |
| P25100 | ADRA1D | Alpha-1D adrenergic receptor | inhibitor | targets |
| P28223 | HTR2A | 5-hydroxytryptamine receptor 2A | inhibitor | targets |
| P35348 | ADRA1A | Alpha-1A adrenergic receptor | inhibitor | targets |
| P35368 | ADRA1B | Alpha-1B adrenergic receptor | inhibitor | targets |
| P35462 | DRD3 | D(3) dopamine receptor | inhibitor | targets |