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| Stem definition | Drug id | CAS RN |
|---|---|---|
| antibacterials, nalidixic acid derivatives | 4053 | 194804-75-6 |
| Dose | Unit | Route |
|---|---|---|
| 0.40 | g | O |
| Property | Value | Reference |
|---|---|---|
| Vd (Volume of distribution) | 1 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 1.23 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| fu (Fraction unbound in plasma) | 0.25 % | Lombardo F, Berellini G, Obach RS |
| S (Water solubility) | 10 mg/mL | Bocci G, Oprea TI, Benet LZ |
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 3 | Bocci G, Oprea TI, Benet LZ |
| BA (Bioavailability) | 0.92 % | Kawashima H, Watanabe R, Esaki T, Kuroda M, Nagao C, Natsume-Kitatani Y, Ohashi R, Komura H, Mizuguchi K |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | GRK2,PDK1,PDK2,PDK4 | 4 | |||
| kinase-selectivity-class | ACVR2B,AXL,CDK9,DYRK1B,EIF2AK3,GRK2,MAP2K6,MAPK7,PIK3CD,PRKDC,STK33,TGFBR1,TTK | 13 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 1 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| May 30, 2007 | PMDA |
None
None
| MedDRA adverse event term | Likelihood ratio | Likelihood ratio threshold | Patients taking drug having adverse event | Patients taking drug not having adverse event | Patients not taking drug having adverse event | Patients not taking drug not having adverse event |
|---|---|---|---|---|---|---|
| Interstitial lung disease | 44.60 | 39.10 | 21 | 757 | 139313 | 110449208 |
| Pneumonia | 41.70 | 39.10 | 40 | 738 | 876674 | 109711847 |
None
| Source | Code | Description |
|---|---|---|
| ATC | J01MA19 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIBACTERIALS FOR SYSTEMIC USE QUINOLONE ANTIBACTERIALS Fluoroquinolones |
| MeSH PA | D000890 | Anti-Infective Agents |
| MeSH PA | D000900 | Anti-Bacterial Agents |
| MeSH PA | D000970 | Antineoplastic Agents |
| MeSH PA | D004791 | Enzyme Inhibitors |
| MeSH PA | D059003 | Topoisomerase Inhibitors |
| MeSH PA | D059005 | Topoisomerase II Inhibitors |
| CHEBI has role | CHEBI:33282 | antibacterial agent |
| CHEBI has role | CHEBI:35475 | non-steroidal anti-inflammatory drug |
| CHEBI has role | CHEBI:36047 | antibacterial drug |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Peritonsillar abscess | indication | 15033003 | |
| Sinusitis | indication | 36971009 | |
| Bacterial pneumonia | indication | 53084003 | DOID:874 |
| Infective otitis media | indication | 312218008 | |
| Infective laryngitis | indication | 312423006 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 6.37 | acidic |
| pKa2 | 8.85 | Basic |
| pKa3 | 0.41 | Basic |
None
None
None
| ID | Source |
|---|---|
| D02540 | KEGG_DRUG |
| C1507405 | UMLSCUI |
| CHEBI:131716 | CHEBI |
| CHEMBL215303 | ChEMBL_ID |
| DB06160 | DRUGBANK_ID |
| C419689 | MESH_SUPPLEMENTAL_RECORD_UI |
| 124093 | PUBCHEM_CID |
| 12402 | IUPHAR_LIGAND_ID |
| 8237 | INN_ID |
| 223652-90-2 | SECONDARY_CAS_RN |
| V72H9867WB | UNII |
| CHEMBL3183451 | ChEMBL_ID |
None