Stem definition | Drug id | CAS RN |
---|---|---|
anticoagulants, dicoumarol derivatives | 867 | 66-76-2 |
Dose | Unit | Route |
---|---|---|
0.10 | g | O |
Property | Value | Reference |
---|---|---|
BDDCS (Biopharmaceutical Drug Disposition Classification System) | 2 | Benet LZ, Broccatelli F, Oprea TI |
S (Water solubility) | 0.13 mg/mL | Benet LZ, Broccatelli F, Oprea TI |
EoM (Fraction excreted unchanged in urine) | 0.50 % | Benet LZ, Broccatelli F, Oprea TI |
MRTD (Maximum Recommended Therapeutic Daily Dose) | 8.50 ยตM/kg/day | Contrera JF, Matthews EJ, Kruhlak NL, Benz RD |
Date | Agency | Company | Orphan |
---|---|---|---|
July 31, 1944 | FDA | ABBVIE |
None
None
None
None
Source | Code | Description |
---|---|---|
ATC | B01AA01 | BLOOD AND BLOOD FORMING ORGANS ANTITHROMBOTIC AGENTS ANTITHROMBOTIC AGENTS Vitamin K antagonists |
CHEBI has role | CHEBI:50249 | anticoagulants |
CHEBI has role | CHEBI:50390 | NAD(P)H dehydrogenase (quinone) inhibitors |
CHEBI has role | CHEBI:55347 | vitamin K antagonists |
CHEBI has role | CHEBI:63962 | Hsp90 inhibitors |
MeSH PA | D000925 | Anticoagulants |
MeSH PA | D004791 | Enzyme Inhibitors |
MeSH PA | D006401 | Hematologic Agents |
MeSH PA | D014475 | Uncoupling Agents |
Disease | Relation | SNOMED_ID | DOID |
---|---|---|---|
Myocardial infarction | indication | 22298006 | DOID:5844 |
Cerebral embolism | indication | 75543006 | DOID:4372 |
Thromboembolic disorder | indication | 371039008 | |
Thrombosis | indication | 439127006 | |
Prevention of Cerebral Thrombosis | indication | ||
Prosthetic replacement of heart valve | off-label use | 307279007 | |
Nutritional disorder | contraindication | 2492009 | DOID:374 |
Pericarditis | contraindication | 3238004 | DOID:1787 |
Necrosis | contraindication | 6574001 | |
Alcoholism | contraindication | 7200002 | |
Obstruction of bile duct | contraindication | 30144000 | |
Vasculitis | contraindication | 31996006 | DOID:865 |
Hyperthyroidism | contraindication | 34486009 | DOID:7998 |
Gangrene | contraindication | 36024000 | |
Hypertensive disorder | contraindication | 38341003 | DOID:10763 |
Gastrointestinal ulcer | contraindication | 40845000 | |
Hypothyroidism | contraindication | 40930008 | DOID:1459 |
Secondary uterine inertia | contraindication | 43715006 | |
Tropical sprue | contraindication | 47384003 | DOID:10607 |
Nephrotic syndrome | contraindication | 52254009 | DOID:1184 |
Vitamin K deficiency | contraindication | 52675005 | DOID:11249 |
Threatened abortion | contraindication | 54048003 | DOID:9667 |
Hyperlipidemia | contraindication | 55822004 | DOID:1168 |
Hepatic failure | contraindication | 59927004 | |
Cerebrovascular disease | contraindication | 62914000 | DOID:6713 |
Blood coagulation disorder | contraindication | 64779008 | DOID:1247 |
Fatty stool | contraindication | 66187002 | |
Psychotic disorder | contraindication | 69322001 | |
Heparin-induced thrombocytopenia | contraindication | 73397007 | |
Gastrointestinal hemorrhage | contraindication | 74474003 | |
Protein C deficiency disease | contraindication | 76407009 | DOID:3756 |
Respiratory tract hemorrhage | contraindication | 95431003 | |
Disorder of connective tissue | contraindication | 105969002 | DOID:65 |
Polycythemia vera | contraindication | 109992005 | |
Procedure on central nervous system | contraindication | 118679007 | |
Intracranial aneurysm | contraindication | 128609009 | DOID:10941 |
Bleeding | contraindication | 131148009 | |
Impaired renal function disorder | contraindication | 197663003 | |
Eclampsia in pregnancy | contraindication | 198992004 | |
Local anesthetic intrathecal block | contraindication | 231249005 | |
Disease of liver | contraindication | 235856003 | DOID:409 |
Chronic diarrhea | contraindication | 236071009 | |
Edema | contraindication | 267038008 | |
Anemia | contraindication | 271737000 | DOID:2355 |
Cerebral hemorrhage | contraindication | 274100004 | |
Lumbar puncture | contraindication | 277762005 | |
Pregnancy, function | contraindication | 289908002 | |
Bacterial endocarditis | contraindication | 301183007 | |
Dissection of aorta | contraindication | 308546005 | |
Primary malignant neoplasm | contraindication | 372087000 | |
Surgical procedure on eye proper | contraindication | 373353005 | |
Pericardial effusion | contraindication | 373945007 | DOID:118 |
Fever | contraindication | 386661006 | |
Surgical procedure | contraindication | 387713003 | |
Severe diarrhea | contraindication | 409587002 | |
Traumatic injury | contraindication | 417746004 | |
Genitourinary tract hemorrhage | contraindication | 417941003 | |
Poor metabolizer due to cytochrome p450 CYP2C9 variant | contraindication | 424451001 | |
Hypertensive urgency | contraindication | 443482000 | |
Severe Diabetes Mellitus | contraindication | ||
Cholesterol Embolism | contraindication | ||
Internal Hemorrhage | contraindication | ||
Indwelling Vascular Catheter | contraindication | ||
Bleeding Risk Associated with Vitamin-K-Epoxide Reductase (Warfarin-Sensitive) Gene | contraindication |
None
None
Dissociation level | Dissociation constant | Type (acidic/basic) |
---|---|---|
pKa1 | 4.26 | acidic |
pKa2 | 8.21 | acidic |
None
None
Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
---|---|---|---|---|---|---|---|---|---|
Vitamin K epoxide reductase complex subunit 1 | Enzyme | INHIBITOR | IC50 | 5.51 | SCIENTIFIC LITERATURE | CHEMBL | |||
NAD(P)H dehydrogenase [quinone] 1 | Enzyme | Ki | 8 | WOMBAT-PK | |||||
Mitogen-activated protein kinase 1 | Kinase | IC50 | 5.35 | DRUG MATRIX | |||||
Proprotein convertase subtilisin/kexin type 7 | Enzyme | IC50 | 5.89 | CHEMBL | |||||
Cytochrome P450 2C9 | Enzyme | Ki | 5.97 | WOMBAT-PK | |||||
G-protein coupled receptor 35 | GPCR | Ki | 7.41 | CHEMBL | |||||
Aldose reductase | Enzyme | IC50 | 5.39 | DRUG MATRIX | |||||
Enoyl-[acyl-carrier-protein] reductase [NADH] | Enzyme | IC50 | 4.33 | CHEMBL | |||||
Urease | Enzyme | IC50 | 4.82 | CHEMBL | |||||
ATP phosphoribosyltransferase | Enzyme | Ki | 4.22 | CHEMBL | |||||
NAD(P)H dehydrogenase [quinone] 1 | Enzyme | Ki | 9 | CHEMBL |
ID | Source |
---|---|
4018715 | VUID |
N0000147021 | NUI |
D03798 | KEGG_DRUG |
1598 | RXNORM |
4018715 | VANDF |
C0005640 | UMLSCUI |
CHEBI:4513 | CHEBI |
DTC | PDB_CHEM_ID |
CHEMBL1466 | ChEMBL_ID |
DB00266 | DRUGBANK_ID |
54676038 | PUBCHEM_CID |
6808 | IUPHAR_LIGAND_ID |
1065 | MMSL |
4586 | MMSL |
d03889 | MMSL |
002082 | NDDF |
423414002 | SNOMEDCT_US |
79209008 | SNOMEDCT_US |
D001728 | MESH_DESCRIPTOR_UI |
2897 | INN_ID |
7QID3E7BG7 | UNII |
None