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| Stem definition | Drug id | CAS RN |
|---|---|---|
| acridine derivatives | 2277 | 92-62-6 |
None
None
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR1B,ACVR2A,ACVR2B,ACVRL1,AKT1,AKT2,AKT3,ALK,AURKA,AURKB,AURKC,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK1,CDK4,CDK5,CDK9,CHEK1,CSF1R,DDR1,DYRK1B,EIF2AK3,EPHA2,EPHB4,ERBB2,FGFR1,FLT3,GRK1,GRK2,GRK3,GSK3B,IKBKB,IRAK1,ITK,JAK1,JAK2,KDR,KIT,MAP2K1,MAP2K6,MAP3K1,MAP3K10,MAP3K11,MAP3K14,MAP3K21,MAP3K7,MAP3K8,MAP4K1,MAP4K3,MAP4K5,MAPK1,MAPK10,MAPK12,MAPK14,MAPK7,MAPK8,MAPK9,MAPKAPK2,MAPKAPK5,MARK4,MELK,MTOR,NTRK2,PAK4,PDK1,PDK2,PDK4,PDPK1,PIK3CA,PIK3CB,PIK3CD,PIM1,PIM2,PLK1,PRKAA1,PRKAA2,PRKCD,PRKDC,SGK1,SIK2,SIK3,SRC,STK10,STK33,SYK,TEK,TGFBR1,TTK,ULK1,ULK2,ZAP70 | 94 | |||
| kinase-selectivity-class | ACVR2A,AURKA,AURKB,AXL,CAMK2D,DYRK1B,GRK2,IKBKB,MAP2K3,MAP2K6,MAP3K14,MAP3K21,MAP3K7,MAPK12,MAPK7,MARK4,SGK1,SIK2,SIK3,STK33,SYK,TEK,TTK,ULK1 | 24 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| None | FDA |
None
None
None
None
| Source | Code | Description |
|---|---|---|
| MeSH PA | D000890 | Anti-Infective Agents |
| MeSH PA | D000891 | Anti-Infective Agents, Local |
| CHEBI has role | CHEBI:23240 | chromophores |
| CHEBI has role | CHEBI:24853 | intercalating agents |
| CHEBI has role | CHEBI:33282 | bactericides |
| CHEBI has role | CHEBI:48218 | antiseptics |
| CHEBI has role | CHEBI:50903 | carcinogen |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Antiseptic preparation | indication | 261276004 | |
| Candidiasis of skin | off-label use | 49883006 | |
| Vaginal irritation | contraindication | 161816004 | |
| Aphthous ulcer of mouth | contraindication | 426965005 | DOID:9663 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.12 | Basic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Replicase polyprotein 1ab | Enzyme | IC50 | 5.84 | CHEMBL |
| ID | Source |
|---|---|
| 4019908 | VUID |
| N0000147993 | NUI |
| 1811-28-5 | SECONDARY_CAS_RN |
| 553-30-0 | SECONDARY_CAS_RN |
| 4018859 | VANDF |
| 4018860 | VANDF |
| 4019908 | VANDF |
| C0033294 | UMLSCUI |
| CHEBI:8452 | CHEBI |
| PF | PDB_CHEM_ID |
| CHEMBL55400 | ChEMBL_ID |
| DB01123 | DRUGBANK_ID |
| CHEMBL465704 | ChEMBL_ID |
| CHEMBL1964546 | ChEMBL_ID |
| D011370 | MESH_DESCRIPTOR_UI |
| 7099 | PUBCHEM_CID |
| 4181 | INN_ID |
| CY3RNB3K4T | UNII |
| 8723 | RXNORM |
| 12419 | MMSL |
| 002618 | NDDF |
| 002620 | NDDF |
| 395844000 | SNOMEDCT_US |
| 418275007 | SNOMEDCT_US |
| Product | Category | Ingredients | NDC | Form | Quantity | Route | Marketing | Label |
|---|---|---|---|---|---|---|---|---|
| Perineze Triple Dye | HUMAN OTC DRUG LABEL | 3 | 55739-1022 | SOLUTION | 1.14 mg | TOPICAL | OTC monograph not final | 10 sections |