Molecule Details
| InChIKey | LBOJYSIDWZQNJS-CVEARBPZSA-N |
|---|---|
| Compound Name | Dizocilpine |
| Canonical SMILES | C[C@]12N[C@H](Cc3ccccc31)c1ccccc12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 9 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.37 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB20240 |
|---|---|
| Drug Name | Dizocilpine |
| CAS Number | 77086-21-6 |
| Groups | experimental |
| ATC Codes | nan |
| Description | Dizocilpine is a small molecule drug. Dizocilpine has a monoisotopic molecular weight of 221.12 Da. |
Categories: Benzocycloheptenes Central Nervous System Agents Dibenzocycloheptenes Excitatory Amino Acid Agents Excitatory Amino Acid Antagonists Neuroprotective Agents Neurotransmitter Agents Protective Agents
Cross-references: BindingDB: 50344263 ChEBI: 34725 CHEMBL284237 C13737 PDB: BMK ZINC: ZINC000025757829
Target Activities (9)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P08912 | CHRM5 | Homo sapiens | Human | PF00001 | 8.7 | IC50 | ChEMBL |
| O15399 | GRIN2D | Homo sapiens | Human | PF01094 PF00060 PF10613 | 8.5 | Ki | ChEMBL |
| O60391 | GRIN3B | Homo sapiens | Human | PF00060 PF10613 | 8.5 | Ki | ChEMBL |
| Q14957 | GRIN2C | Homo sapiens | Human | PF01094 PF00060 PF10613 PF10565 | 8.5 | Ki | ChEMBL |
| Q8TCU5 | GRIN3A | Homo sapiens | Human | PF01094 PF00060 PF10613 | 8.5 | Ki | ChEMBL |
| P42785 | PRCP | Homo sapiens | Human | PF05577 | 8.3 | IC50 | ChEMBL;BindingDB |
| Q05586 | GRIN1 | Homo sapiens | Human | PF01094 PF00060 PF10613 | 8.2 | Ki | ChEMBL |
| Q13224 | GRIN2B | Homo sapiens | Human | PF01094 PF00060 PF10613 PF10565 | 8.2 | Ki | ChEMBL |
| Q12879 | GRIN2A | Homo sapiens | Human | PF01094 PF00060 PF10613 PF10565 | 7.9 | IC50 | ChEMBL;BindingDB |
DrugBank Target Actions (4)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P0DMS8 | ADORA3 | Adenosine receptor A3 | inhibitor | targets |
| Q05586 | GRIN1 | Glutamate receptor ionotropic, NMDA 1 | inhibitor | targets |
| Q12879 | GRIN2A | Glutamate receptor ionotropic, NMDA 2A | inhibitor | targets |
| Q13224 | GRIN2B | Glutamate receptor ionotropic, NMDA 2B | inhibitor | targets |