Molecule Details
| InChIKey | AYXYPKUFHZROOJ-ZETCQYMHSA-N |
|---|---|
| Compound Name | Pregabalin |
| Canonical SMILES | CC(C)C[C@H](CN)CC(=O)O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.36 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB00230 |
|---|---|
| Drug Name | Pregabalin |
| CAS Number | 148553-50-8 |
| Groups | approved investigational |
| ATC Codes | N02BF02 |
| Description | Pregabalin is structurally similar to gamma-aminobutyric acid (GABA) - an inhibitory neurotransmitter.[A173995] It may be used to manage neuropathic pain, postherpetic neuralgia, and fibromyalgia among other conditions.[A187190] Although as per the FDA Label the mechanism of action has not been defi... |
Categories: Acids, Acyclic Agents causing angioedema Amino Acids Amino Acids, Peptides, and Proteins Aminobutyrates Analgesics Anti-Anxiety Agents Anticonvulsants Bradycardia-Causing Agents Butyrates Central Nervous System Agents Central Nervous System Depressants Drugs that are Mainly Renally Excreted Gabapentinoids Hypoglycemia-Associated Agents Membrane Transport Modulators Miscellaneous Anticonvulsants Muscle Relaxants Muscle Relaxants, Centrally Acting Agents Nervous System Peripheral Nervous System Agents Potential QTc-Prolonging Agents Psychotropic Drugs QTc Prolonging Agents Sensory System Agents Tranquilizing Agents Vasodilating Agents
Cross-references: BindingDB: 50164279 ChEBI: 64356 CHEMBL1059 ChemSpider: 4589156 Drugs Product Database (DPD): 15568 D02716 PharmGKB: PA164754814 PubChem:5486971 PubChem:46504934 RxCUI: 187832 Therapeutic Targets Database: DAP001264 Wikipedia: Pregabalin ZINC: ZINC000000005152