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| Stem definition | Drug id | CAS RN |
|---|---|---|
| antibiotics, 6-aminopenicillanic acid derivatives | 508 | 35531-88-5 |
| Dose | Unit | Route |
|---|---|---|
| 4 | g | O |
| Property | Value | Reference |
|---|---|---|
| BA (Bioavailability) | 35 % | |
| BA (Bioavailability) | 69 % |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,AURKA,AXL,BRAF,BTK,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EGFR,EIF2AK3,ERBB2,GRK2,GSK3B,ITK,JAK2,JAK3,MAP2K6,MAP3K21,MAP3K7,MAPK7,MAPKAPK2,NTRK2,PDK1,PDK2,PDK4,PIK3CB,PIK3CG,PIM2,PRKDC,STK33,SYK,TEK,TGFBR1,TTK,ZAP70 | 38 | |||
| kinase-selectivity-class | AXL,EIF2AK3,GRK2,MAP2K6 | 4 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Oct. 26, 1972 | FDA | PFIZER |
None
None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | J01CA05 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIBACTERIALS FOR SYSTEMIC USE BETA-LACTAM ANTIBACTERIALS, PENICILLINS Penicillins with extended spectrum |
| FDA CS | M0016152 | Penicillins |
| FDA EPC | N0000175497 | Penicillin-class Antibacterial |
| CHEBI has role | CHEBI:33282 | antibacterial agent |
| CHEBI has role | CHEBI:36047 | antibacterial drug |
| MeSH PA | D000890 | Anti-Infective Agents |
| MeSH PA | D000900 | Anti-Bacterial Agents |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Bacterial urinary infection | indication | 312124009 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 2.79 | acidic |
| pKa2 | 10.77 | acidic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Bacterial penicillin-binding protein | Enzyme | INHIBITOR | CHEMBL | CHEMBL |
| ID | Source |
|---|---|
| 4018408 | VUID |
| N0000146734 | NUI |
| D01283 | KEGG_DRUG |
| 2015 | RXNORM |
| C0054667 | UMLSCUI |
| CHEBI:52015 | CHEBI |
| 0JM | PDB_CHEM_ID |
| CHEMBL1596 | ChEMBL_ID |
| CHEMBL1200991 | ChEMBL_ID |
| DB09319 | DRUGBANK_ID |
| 12276 | IUPHAR_LIGAND_ID |
| 26605-69-6 | SECONDARY_CAS_RN |
| 93184 | PUBCHEM_CID |
| 4352 | MMSL |
| d00092 | MMSL |
| 34731007 | SNOMEDCT_US |
| 372713001 | SNOMEDCT_US |
| 63188000 | SNOMEDCT_US |
| C0006976 | UMLSCUI |
| DB00578 | DRUGBANK_ID |
| 20824 | PUBCHEM_CID |
| 3405 | INN_ID |
| 2516 | INN_ID |
| 4018408 | VANDF |
| 4019654 | VANDF |
| C100244 | MESH_SUPPLEMENTAL_RECORD_UI |
| D002228 | MESH_DESCRIPTOR_UI |
| 5V278481KE | UNII |
| 002700 | NDDF |
| 002702 | NDDF |
| CHEBI:3393 | CHEBI |
| 5V278481KE | INXIGHT DRUGS |
None