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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 3481 | 518-28-5 |
None
None
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2B,AKT3,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,GRK2,GSK3B,ITK,JAK2,JAK3,MAP3K21,MAP3K7,MAPK10,MAPK7,MAPK9,MAPKAPK2,MET,MTOR,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CA,PIK3CB,PIK3CD,PIK3CG,PIM2,PRKDC,SIK2,SIK3,STK33,TEK,TTK,ZAP70 | 45 | |||
| kinase-selectivity-class | ACVR2B,AXL,EPHB4,GRK2,PDK4 | 5 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Dec. 13, 1990 | FDA | ACTAVIS LABS UT INC |
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None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | D06BB04 | DERMATOLOGICALS ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE CHEMOTHERAPEUTICS FOR TOPICAL USE Antivirals |
| FDA PE | N0000008732 | Decreased Mitosis |
| MeSH PA | D000970 | Antineoplastic Agents |
| MeSH PA | D000972 | Antineoplastic Agents, Phytogenic |
| MeSH PA | D003879 | Dermatologic Agents |
| MeSH PA | D007641 | Keratolytic Agents |
| MeSH PA | D050256 | Antimitotic Agents |
| MeSH PA | D050257 | Tubulin Modulators |
| CHEBI has role | CHEBI:22587 | antiviral agent |
| CHEBI has role | CHEBI:35610 | antineoplastic agent |
| CHEBI has role | CHEBI:50176 | keratolytic drug |
| CHEBI has role | CHEBI:60832 | tubulin modulator |
| CHEBI has role | CHEBI:61951 | microtubule-destabilising agent |
| CHEBI has role | CHEBI:64911 | antimitotic |
| CHEBI has role | CHEBI:76924 | plant metabolite |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Condyloma acuminatum | indication | 240542006 | DOID:11168 |
| Pregnancy, function | contraindication | 289908002 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 10.37 | acidic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Cytochrome P450 3A4 | Enzyme | IC50 | 6.22 | DRUG MATRIX | |||||
| Glucocorticoid receptor | Nuclear hormone receptor | IC50 | 7.85 | CHEMBL | |||||
| Cytochrome P450 2C9 | Enzyme | IC50 | 5.40 | DRUG MATRIX | |||||
| Cytochrome P450 2C19 | Enzyme | IC50 | 5.30 | DRUG MATRIX | |||||
| Tubulin | Structural | IC50 | 6 | CHEMBL | |||||
| Regulatory protein E2 | Transcription factor | Kd | 4.70 | CHEMBL | |||||
| Tubulin alpha-1A chain | Structural | IC50 | 6.34 | CHEMBL | |||||
| Regulatory protein E2 | Transcription factor | Kd | 5.98 | CHEMBL | |||||
| Tubulin | Structural | IC50 | 6.34 | CHEMBL | |||||
| Tubulin | Structural | Ki | 5.66 | CHEMBL | |||||
| Human papillomavirus regulatory protein E2 | Transcription factor | Kd | 4.15 | CHEMBL |
| ID | Source |
|---|---|
| 4019583 | VUID |
| N0000147681 | NUI |
| D05529 | KEGG_DRUG |
| 4019583 | VANDF |
| C0032334 | UMLSCUI |
| CHEBI:50305 | CHEBI |
| POD | PDB_CHEM_ID |
| CHEMBL61 | ChEMBL_ID |
| D011034 | MESH_DESCRIPTOR_UI |
| DB01179 | DRUGBANK_ID |
| 10607 | PUBCHEM_CID |
| 225782 | RXNORM |
| 5312 | MMSL |
| 003584 | NDDF |
| 415128000 | SNOMEDCT_US |
| 76575003 | SNOMEDCT_US |
| 13598 | IUPHAR_LIGAND_ID |
| L36H50F353 | UNII |
| Product | Category | Ingredients | NDC | Form | Quantity | Route | Marketing | Label |
|---|---|---|---|---|---|---|---|---|
| Condylox | HUMAN PRESCRIPTION DRUG LABEL | 1 | 0023-6118 | GEL | 5 mg | TOPICAL | NDA | 23 sections |
| PODOFILOX | HUMAN PRESCRIPTION DRUG LABEL | 1 | 0574-0611 | SOLUTION | 5 mg | TOPICAL | ANDA | 23 sections |
| Podofilox | HUMAN PRESCRIPTION DRUG LABEL | 1 | 0574-0621 | GEL | 5 mg | TOPICAL | ANDA | 20 sections |
| Podofilox | HUMAN PRESCRIPTION DRUG LABEL | 1 | 54868-6198 | SOLUTION | 5 mg | TOPICAL | NDA authorized generic | 20 sections |