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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 313 | 972-02-1 |
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| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,AKT1,AKT2,AKT3,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,ITK,JAK2,JAK3,MAP3K21,MAP3K7,MAPK12,MAPK7,MET,NTRK2,PDK2,PDK4,PDPK1,PIM2,PRKDC,SIK2,SIK3,TEK,TGFBR1 | 38 | |||
| kinase-selectivity-class | AXL,EPHB4,ERBB2,GRK2,PDK4,SIK2,SIK3,STK33,TEK | 9 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| April 5, 1967 | FDA |
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| Source | Code | Description |
|---|---|---|
| FDA PE | N0000009034 | Emesis Suppression |
| MeSH PA | D000932 | Antiemetics |
| MeSH PA | D002491 | Central Nervous System Agents |
| MeSH PA | D005765 | Gastrointestinal Agents |
| MeSH PA | D018373 | Peripheral Nervous System Agents |
| CHEBI has role | CHEBI:50919 | antiemetic |
| FDA EPC | N0000178372 | Antiemetic |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Vertigo | indication | 399153001 |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.28 | Basic |
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| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | GPCR | ANTAGONIST | Ki | 7.11 | DRUG MATRIX | CHEMBL | |||
| Sigma non-opioid intracellular receptor 1 | Membrane receptor | Ki | 6.97 | DRUG MATRIX | |||||
| 5-hydroxytryptamine receptor 2A | GPCR | Ki | 6.13 | DRUG MATRIX | |||||
| D(3) dopamine receptor | GPCR | Ki | 6.11 | DRUG MATRIX | |||||
| Muscarinic acetylcholine receptor M2 | GPCR | Ki | 6.56 | DRUG MATRIX | |||||
| Muscarinic acetylcholine receptor M3 | GPCR | Ki | 7.28 | DRUG MATRIX | |||||
| Muscarinic acetylcholine receptor M4 | GPCR | Ki | 7.42 | DRUG MATRIX | |||||
| Muscarinic acetylcholine receptor M5 | GPCR | Ki | 6.07 | DRUG MATRIX | |||||
| Cytochrome P450 2D6 | Enzyme | IC50 | 6.49 | DRUG MATRIX | |||||
| D(2) dopamine receptor | GPCR | Ki | 5.96 | DRUG MATRIX | |||||
| Sodium channel alpha subunits; brain (Types I, II, III) | Ion channel | IC50 | 5.47 | CHEMBL | |||||
| Alpha-1B adrenergic receptor | GPCR | Ki | 5.58 | DRUG MATRIX |
| ID | Source |
|---|---|
| D01318 | KEGG_DRUG |
| 23370 | RXNORM |
| CHEBI:4638 | CHEBI |
| CHEMBL936 | ChEMBL_ID |
| CHEMBL1529 | ChEMBL_ID |
| C004858 | MESH_SUPPLEMENTAL_RECORD_UI |
| 7163 | IUPHAR_LIGAND_ID |
| 3254-89-5 | SECONDARY_CAS_RN |
| DB01231 | DRUGBANK_ID |
| NQO8R319LY | UNII |
| C0058371 | UMLSCUI |
| 1433 | INN_ID |
| 3055 | PUBCHEM_CID |
| 4018019 | VANDF |
| 4019725 | VANDF |
| 001681 | NDDF |
| 001682 | NDDF |
| 32030002 | SNOMEDCT_US |
| 63779001 | SNOMEDCT_US |
| 767579009 | SNOMEDCT_US |
| NQO8R319LY | INXIGHT DRUGS |
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