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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 5144 | 90-80-2 |
None
None
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,AURKA,AXL,BRAF,BTK,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,ERBB2,GRK2,ITK,MAP2K6,MAP3K21,MAPK10,MAPK7,NTRK2,PDK1,PDK2,PDK4,PIK3CB,PIK3CD,PRKDC,SIK2,STK33,TEK | 30 | |||
| kinase-selectivity-class | ACVRL1,AXL,BMX,CDK1,CDK2,CDK4,CDK7,CDK9,CHUK,DYRK1A,GRK2,INSR,IRAK4,MAP2K6,MAP3K14,PIK3CD,PRKDC,TEK,TGFBR1,ZAP70 | 20 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Oct. 2, 1990 | FDA | UNITED GUARDIAN |
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None
None
None
| Source | Code | Description |
|---|---|---|
| FDA MoA | N0000175534 | Irrigation |
| FDA EPC | N0000175835 | Calculi Dissolution Agent |
| CHEBI has role | CHEBI:75767 | animal metabolites |
| CHEBI has role | CHEBI:75771 | Mus musculus metabolites |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Urinary bladder stone | indication | 70650003 | DOID:11355 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 11.96 | acidic |
| pKa2 | 12.58 | acidic |
| pKa3 | 13.31 | acidic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Glucosylceramidase | Enzyme | Ki | 4.52 | CHEMBL |
| ID | Source |
|---|---|
| WQ29KQ9POT | UNII |
| 4019568 | VANDF |
| C0061387 | UMLSCUI |
| CHEBI:16217 | CHEBI |
| LGC | PDB_CHEM_ID |
| CHEMBL1200829 | ChEMBL_ID |
| D04332 | KEGG_DRUG |
| 7027 | PUBCHEM_CID |
| DB04564 | DRUGBANK_ID |
| 25842 | RXNORM |
| NOCODE | MMSL |
| d03715 | MMSL |
| 005159 | NDDF |
| 427638006 | SNOMEDCT_US |
| Product | Category | Ingredients | NDC | Form | Quantity | Route | Marketing | Label |
|---|---|---|---|---|---|---|---|---|
| Renacidin | HUMAN PRESCRIPTION DRUG LABEL | 3 | 0327-0012 | SOLUTION | 0.20 g | IRRIGATION | NDA | 14 sections |
| Krx Aesthetics Biophase Molecular Night Peel | HUMAN OTC DRUG LABEL | 2 | 84755-0005 | CREAM | 100 mg | TOPICAL | unapproved drug other | 8 sections |