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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 2206 | 60762-57-4 |
None
| Property | Value | Reference |
|---|---|---|
| BA (Bioavailability) | 25 % |
| 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,IRAK4,ITK,JAK2,JAK3,MAP2K6,MAP3K21,MAP3K7,MAPK10,MAPK12,MAPK7,MAPKAPK2,MET,NTRK2,PDK2,PDK4,PDPK1,PIK3CB,PIM2,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK,ZAP70 | 49 | |||
| kinase-selectivity-class | AXL,EIF2AK3,PRKCZ,TTK | 4 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
None
None
None
None
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| Source | Code | Description |
|---|---|---|
| MeSH PA | D000928 | Antidepressive Agents |
| MeSH PA | D000970 | Antineoplastic Agents |
| MeSH PA | D002491 | Central Nervous System Agents |
| MeSH PA | D004791 | Enzyme Inhibitors |
| MeSH PA | D008996 | Monoamine Oxidase Inhibitors |
| MeSH PA | D011619 | Psychotropic Drugs |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Depressive disorder | indication | 35489007 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.43 | Basic |
None
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| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Amine oxidase [flavin-containing] A | Enzyme | INHIBITOR | Ki | 7.41 | SCIENTIFIC LITERATURE | SCIENTIFIC LITERATURE | |||
| Transcriptional enhancer factor TEF-1 | Transcription factor | Kd | 4.92 | CHEMBL | |||||
| Transcriptional enhancer factor TEF-3 | Transcription factor | IC50 | 4.44 | CHEMBL | |||||
| Transcriptional enhancer factor TEF-4 | Transcription factor | IC50 | 4.48 | CHEMBL | |||||
| Transcriptional enhancer factor TEF-5 | Transcription factor | IC50 | 4.36 | CHEMBL |
| ID | Source |
|---|---|
| D08392 | KEGG_DRUG |
| 16154-78-2 | SECONDARY_CAS_RN |
| C0071143 | UMLSCUI |
| CHEBI:748117 | CHEBI |
| CHEMBL32350 | ChEMBL_ID |
| DB09244 | DRUGBANK_ID |
| 68802 | PUBCHEM_CID |
| C009830 | MESH_SUPPLEMENTAL_RECORD_UI |
| 6638 | IUPHAR_LIGAND_ID |
| 4615 | INN_ID |
| 207572-66-5 | SECONDARY_CAS_RN |
| V39YPH45FZ | UNII |
| V39YPH45FZ | INXIGHT DRUGS |
None