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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 2603 | 15793-40-5 |
| Dose | Unit | Route |
|---|---|---|
| 50 | mg | O |
| Property | Value | Reference |
|---|---|---|
| BA (Bioavailability) | 82 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
| Vd (Volume of distribution) | 5.10 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 1.10 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| fu (Fraction unbound in plasma) | 0.08 % | Lombardo F, Berellini G, Obach RS |
| t_half (Half-life) | 56 hours | Lombardo F, Berellini G, Obach RS |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,AKT1,AKT2,AKT3,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,ITK,JAK2,JAK3,MAP3K21,MAP3K7,MAPK10,MAPK12,MAPK7,MAPKAPK2,MET,MTOR,NTRK2,PDK2,PDK4,PDPK1,PIK3CB,PIM2,PRKDC,SIK2,SIK3,STK33,TEK,TGFBR1,TTK | 45 | |||
| kinase-selectivity-class | AKT3,AXL,GRK2,PDK4 | 4 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
None
None
None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | G04BD05 | GENITO URINARY SYSTEM AND SEX HORMONES UROLOGICALS UROLOGICALS Drugs for urinary frequency and incontinence |
| MeSH PA | D000077264 | Calcium-Regulating Hormones and Agents |
| MeSH PA | D002121 | Calcium Channel Blockers |
| MeSH PA | D002317 | Cardiovascular Agents |
| MeSH PA | D010276 | Parasympatholytics |
| MeSH PA | D018373 | Peripheral Nervous System Agents |
| MeSH PA | D049990 | Membrane Transport Modulators |
| CHEBI has role | CHEBI:35846 | renal agent |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Urinary incontinence | indication | 165232002 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 10.07 | Basic |
None
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| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Potassium voltage-gated channel subfamily H member 2 | Ion channel | IC50 | 6.30 | CHEMBL |
| ID | Source |
|---|---|
| D01873 | KEGG_DRUG |
| C0076126 | UMLSCUI |
| CHEBI:135168 | CHEBI |
| CHEMBL363295 | ChEMBL_ID |
| DB13725 | DRUGBANK_ID |
| CHEMBL539770 | ChEMBL_ID |
| C010637 | MESH_SUPPLEMENTAL_RECORD_UI |
| 23480 | PUBCHEM_CID |
| 2077 | INN_ID |
| 7082-21-5 | SECONDARY_CAS_RN |
| 70KG06964W | UNII |
| 235839 | RXNORM |
| 004054 | NDDF |
| 004055 | NDDF |
| 417479000 | SNOMEDCT_US |
| 782604006 | SNOMEDCT_US |
| 70KG06964W | INXIGHT DRUGS |
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