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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 3354 | 1115-84-0 |
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| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| kinase-safety-class | ACVR2A,ACVR2B,AURKA,AXL,BRAF,BTK,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,GRK2,GSK3B,ITK,JAK2,JAK3,KDR,MAP2K6,MAP3K21,MAP3K7,MAPK10,MAPK7,MAPKAPK2,NTRK1,NTRK2,PDK1,PDK2,PDK4,PIK3CB,PIM2,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,ZAP70 | 43 | |||
| kinase-selectivity-class | AXL,BRAF,CDK4,CDK9,EIF2AK3,EPHB4,GRK2,MAP2K6,STK33,TEK,TGFBR1,ZAP70 | 12 | |||
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 |
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| Source | Code | Description |
|---|---|---|
| ATC | A02BX04 | ALIMENTARY TRACT AND METABOLISM DRUGS FOR ACID RELATED DISORDERS DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD) Other drugs for peptic ulcer and gastro-oesophageal reflux disease (GORD) |
| CHEBI has role | CHEBI:75772 | <em>Saccharomyces cerevisiae </em> metabolite |
| CHEBI has role | CHEBI:76971 | <em>Escherichia coli</em> metabolite |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 2.49 | acidic |
| pKa2 | 9.93 | Basic |
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| ID | Source |
|---|---|
| CHEBI:6884 | CHEBI |
| CHEMBL1797128 | ChEMBL_ID |
| DB13250 | DRUGBANK_ID |
| 713357001 | SNOMEDCT_US |
| C0658922 | UMLSCUI |
| 16217806 | PUBCHEM_CID |
| 3485Y39925 | UNII |
| 7O2D9U053L | UNII |
| G9CUR2204U | UNII |
| I798Y91P58 | UNII |
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