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| Stem definition | Drug id | CAS RN |
|---|---|---|
| spasmolytics with a papaverine-like action | 142 | 150-59-4 |
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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,MAPK10,MAPK12,MAPK7,MAPK9,MAPKAPK2,MET,MTOR,NTRK2,PAK4,PDK2,PDK4,PDPK1,PIK3CB,PIM2,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK | 48 | |||
| kinase-selectivity-class | AKT3,AXL,CAMK2D,EIF2AK3,EPHB4,GRK2,PDK4,PRKCD,SIK2,STK33,TEK | 11 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
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| Source | Code | Description |
|---|---|---|
| ATC | A03AX08 | ALIMENTARY TRACT AND METABOLISM DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS Other drugs for functional gastrointestinal disorders |
| ATC | A03AX58 | ALIMENTARY TRACT AND METABOLISM DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS Other drugs for functional gastrointestinal disorders |
| MeSH PA | D010276 | Parasympatholytics |
| MeSH PA | D018373 | Peripheral Nervous System Agents |
| CHEBI has role | CHEBI:35674 | antihypertensive agent |
| CHEBI has role | CHEBI:48873 | cholinergic antagonist |
| CHEBI has role | CHEBI:53784 | antispasmodic drug |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.35 | Basic |
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| ID | Source |
|---|---|
| D02877 | KEGG_DRUG |
| 5982-87-6 | SECONDARY_CAS_RN |
| 17627 | RXNORM |
| C0051528 | UMLSCUI |
| CHEBI:518413 | CHEBI |
| CHEMBL253371 | ChEMBL_ID |
| DB01616 | DRUGBANK_ID |
| C010846 | MESH_SUPPLEMENTAL_RECORD_UI |
| 3678 | PUBCHEM_CID |
| 14185 | IUPHAR_LIGAND_ID |
| 95 | INN_ID |
| 5560-59-8 | SECONDARY_CAS_RN |
| 46TIR1560O | UNII |
| CHEMBL1408594 | ChEMBL_ID |
| 001763 | NDDF |
| 001764 | NDDF |
| 349818006 | SNOMEDCT_US |
| 418483003 | SNOMEDCT_US |
| 91023007 | SNOMEDCT_US |
| 46TIR1560O | INXIGHT DRUGS |
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