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| Stem definition | Drug id | CAS RN |
|---|---|---|
| 830 | 132-21-8 |
None
| Property | Value | Reference |
|---|---|---|
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 1 | Bocci G, Oprea TI, Benet LZ |
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| azlogd74 | LogD at pH 7.4 | 1.873 | Moderate | 0.79 | |
| caco2-efflux | Caco-2 efflux ratio (BA/AB) | 0.346 | Moderate | 0.79 | |
| caco2-intrinsic-papp | Caco-2 intrinsic apparent permeability | 33.963 | 10^-6 cm/s | Moderate | 0.79 |
| dh-clint | Dog hepatocyte intrinsic clearance | 38.548 | uL/min/10^6 cells | Moderate | 0.79 |
| dppb | Dog plasma protein binding (% unbound) | 33.590 | % | Moderate | 0.79 |
| fcs-ppb | Fetal calf serum protein binding (% unbound) | 45.860 | % | Moderate | 0.79 |
| herg | hERG pIC50 | 5.597 | pIC50 | Moderate | 0.79 |
| hh-clint | Human hepatocyte intrinsic clearance | 4.581 | uL/min/10^6 cells | Moderate | 0.79 |
| hlm-clint | Human liver microsomal intrinsic clearance | 13.092 | uL/min/mg protein | Moderate | 0.79 |
| hppb | Human plasma protein binding (% unbound) | 39.730 | % | Moderate | 0.79 |
| kinase-safety-class | ACVR2A,ACVR2B,AKT1,AKT2,AKT3,ALK,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,CHEK1,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,ITK,JAK1,JAK2,JAK3,MAP3K21,MAP3K7,MAPK10,MAPK12,MAPK7,MAPK9,MAPKAPK2,MARK4,MET,MTOR,NTRK2,PAK4,PDK2,PDK4,PDPK1,PIK3CB,PIM2,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK | 52 | |||
| kinase-selectivity-class | AKT2,AKT3,AXL,EIF2AK3,PDK4,PRKCD,STK33 | 7 | |||
| mdck-mdr1-bcrp-efflux | MDCK-MDR1-BCRP efflux ratio | 0.459 | Moderate | 0.79 | |
| mdck-mdr1-efflux | MDCK-MDR1 efflux ratio | 0.332 | Moderate | 0.79 | |
| mh-clint | Mouse hepatocyte intrinsic clearance | 109.144 | Moderate | 0.79 | |
| mppb | Mouse plasma protein binding (% unbound) | 32.670 | Moderate | 0.79 | |
| nih-mdck-mdr1-efflux | NIH MDCK-MDR1 efflux ratio | 1.064 | Moderate | 0.79 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pppb | Pig plasma protein binding (% unbound) | 49.770 | % | Moderate | 0.79 |
| rat-kpuu-brain | Rat brain Kpuu | 1.832 | % | Moderate | 0.79 |
| rh-clint | Rat hepatocyte intrinsic clearance | 97.949 | uL/min/10^6 cells | Moderate | 0.79 |
| rh-fuinc | Rat hepatocyte fraction unbound in incubation | 64.320 | % | Moderate | 0.79 |
| rppb | Rat plasma protein binding (% unbound) | 33.440 | % | Moderate | 0.79 |
| solubility-dd | Solubility at pH 7.4 in DMSO | 961.612 | uM | Moderate | 0.79 |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Oct. 18, 1963 | FDA | SCHERING PLOUGH |
None
None
None
None
| Source | Code | Description |
|---|---|---|
| ATC | R06AB06 | RESPIRATORY SYSTEM ANTIHISTAMINES FOR SYSTEMIC USE ANTIHISTAMINES FOR SYSTEMIC USE Substituted alkylamines |
| ATC | R06AB56 | RESPIRATORY SYSTEM ANTIHISTAMINES FOR SYSTEMIC USE ANTIHISTAMINES FOR SYSTEMIC USE Substituted alkylamines |
| MeSH PA | D006633 | Histamine Antagonists |
| MeSH PA | D006634 | Histamine H1 Antagonists |
| MeSH PA | D018377 | Neurotransmitter Agents |
| MeSH PA | D018494 | Histamine Agents |
| CHEBI has role | CHEBI:37955 | H<small><sub>1</sub></small>-receptor antagonist |
| CHEBI has role | CHEBI:50857 | anti-allergic agent |
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Dermatographic urticaria | indication | 7632005 | DOID:743 |
| Vasomotor rhinitis | indication | 8229003 | DOID:4730 |
| Allergic rhinitis | indication | 61582004 | |
| Urticaria | indication | 126485001 | |
| Influenza-like symptoms | indication | 315642008 | |
| Seasonal allergic rhinitis | indication | 367498001 | |
| Itching of skin | indication | 418363000 | |
| Allergic conjunctivitis | indication | 473460002 | DOID:11204 |
| Ocular hypertension | contraindication | 4210003 | DOID:9282 |
| Suicidal thoughts | contraindication | 6471006 | |
| Dependent drug abuse | contraindication | 6525002 | |
| Alcoholism | contraindication | 7200002 | |
| Alcohol withdrawal delirium | contraindication | 8635005 | |
| Peptic ulcer | contraindication | 13200003 | DOID:750 |
| Asthenia | contraindication | 13791008 | |
| Constipation | contraindication | 14760008 | DOID:2089 |
| Mood swings | contraindication | 18963009 | |
| Myocardial infarction | contraindication | 22298006 | DOID:5844 |
| Inflammatory bowel disease | contraindication | 24526004 | DOID:0050589 |
| Ventricular tachycardia | contraindication | 25569003 | |
| Alcohol intoxication | contraindication | 25702006 | |
| Shock | contraindication | 27942005 | |
| Hypercapnia | contraindication | 29596007 | |
| Dehydration | contraindication | 34095006 | |
| Hyperthyroidism | contraindication | 34486009 | DOID:7998 |
| Acute hepatitis | contraindication | 37871000 | |
| Hypertensive disorder | contraindication | 38341003 | DOID:10763 |
| Disorder of gallbladder | contraindication | 39621005 | DOID:0060262 |
| Hypothyroidism | contraindication | 40930008 | DOID:1459 |
| Conduction disorder of the heart | contraindication | 44808001 | |
| Low blood pressure | contraindication | 45007003 | |
| Chronic heart failure | contraindication | 48447003 | |
| Bradycardia | contraindication | 48867003 | |
| Acidosis | contraindication | 51387008 | |
| Coronary arteriosclerosis | contraindication | 53741008 | DOID:3393 |
| Hepatic failure | contraindication | 59927004 | |
| Ulcerative colitis | contraindication | 64766004 | DOID:8577 |
| Arterial thrombosis | contraindication | 65198009 | |
| Substance abuse | contraindication | 66214007 | |
| Benign intracranial hypertension | contraindication | 68267002 | DOID:11459 |
| Poisoning by acetaminophen | contraindication | 70273001 | |
| Arteriosclerotic vascular disease | contraindication | 72092001 | |
| Diabetes mellitus | contraindication | 73211009 | DOID:9351 |
| Urethral stricture | contraindication | 76618002 | |
| Decreased respiratory function | contraindication | 80954004 | |
| Injury of head | contraindication | 82271004 | |
| Chronic idiopathic constipation | contraindication | 82934008 | |
| Cor pulmonale | contraindication | 83291003 | DOID:8515 |
| Pulmonary emphysema | contraindication | 87433001 | |
| Kidney disease | contraindication | 90708001 | DOID:557 |
| Acute abdominal pain | contraindication | 116290004 | |
| Neoplasm of brain | contraindication | 126952004 | DOID:1319 |
| Seizure disorder | contraindication | 128613002 | |
| Drug-induced psychosis | contraindication | 191483003 | DOID:1742 |
| Partial atrioventricular block | contraindication | 195039008 | |
| Acute pancreatitis | contraindication | 197456007 | DOID:2913 |
| Disease of liver | contraindication | 235856003 | DOID:409 |
| Bladder outflow obstruction | contraindication | 236645006 | |
| Morbid obesity | contraindication | 238136002 | DOID:11981 |
| Benign prostatic hyperplasia | contraindication | 266569009 | |
| Retention of urine | contraindication | 267064002 | |
| Exacerbation of asthma | contraindication | 281239006 | |
| Lesion of brain | contraindication | 301766008 | |
| Coma | contraindication | 371632003 | |
| Primary adrenocortical insufficiency | contraindication | 373662000 | |
| Operation on gastrointestinal tract | contraindication | 386621005 | |
| Hypoxia | contraindication | 389086002 | |
| Angle-closure glaucoma | contraindication | 392291006 | DOID:13550 |
| Disorder of coronary artery | contraindication | 414024009 | |
| Central nervous system depression | contraindication | 418072004 | |
| Dysfunction of sphincter of Oddi | contraindication | 430887001 | |
| Hypertensive urgency | contraindication | 443482000 |
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 9.47 | Basic |
| pKa2 | 4.14 | Basic |
None
None
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Histamine H1 receptor | GPCR | ANTAGONIST | DRUGBANK | CHEMBL |
| ID | Source |
|---|---|
| 4019711 | VUID |
| N0000147803 | NUI |
| D03704 | KEGG_DRUG |
| 2391-03-9 | SECONDARY_CAS_RN |
| 22696 | RXNORM |
| 4018841 | VANDF |
| 4019711 | VANDF |
| C0057605 | UMLSCUI |
| CHEBI:59269 | CHEBI |
| CHEMBL1201287 | ChEMBL_ID |
| CHEMBL1200638 | ChEMBL_ID |
| DB00405 | DRUGBANK_ID |
| C015121 | MESH_SUPPLEMENTAL_RECORD_UI |
| 16960 | PUBCHEM_CID |
| 7588 | IUPHAR_LIGAND_ID |
| 907 | INN_ID |
| 75T64B71RP | UNII |
| 4555 | MMSL |
| d03750 | MMSL |
| 003411 | NDDF |
| 004436 | NDDF |
| 387090008 | SNOMEDCT_US |
| 387429005 | SNOMEDCT_US |
| 75429004 | SNOMEDCT_US |
| 75T64B71RP | INXIGHT DRUGS |
| Product | Category | Ingredients | NDC | Form | Quantity | Route | Marketing | Label |
|---|---|---|---|---|---|---|---|---|
| Dexbrompherniramine Maleate and Pseudoephedrine Sulfate6mg/120mg | HUMAN OTC DRUG LABEL | 2 | 10702-005 | TABLET, EXTENDED RELEASE | 6 mg | ORAL | ANDA | 13 sections |
| Chlo Tuss | HUMAN OTC DRUG LABEL | 3 | 12830-762 | LIQUID | 1 mg | ORAL | OTC Monograph Drug | 16 sections |
| Chlo Tuss | HUMAN OTC DRUG LABEL | 3 | 12830-762 | LIQUID | 1 mg | ORAL | OTC Monograph Drug | 16 sections |
| M-ENDDMX | HUMAN OTC DRUG LABEL | 3 | 12830-816 | LIQUID | 0.67 mg | ORAL | OTC Monograph Drug | 16 sections |
| M-ENDDMX | HUMAN OTC DRUG LABEL | 3 | 12830-816 | LIQUID | 0.67 mg | ORAL | OTC Monograph Drug | 16 sections |
| Chlo Hist | HUMAN OTC DRUG LABEL | 2 | 12830-864 | LIQUID | 1 mg | ORAL | OTC Monograph Drug | 15 sections |
| Chlo Hist | HUMAN OTC DRUG LABEL | 2 | 12830-864 | LIQUID | 1 mg | ORAL | OTC Monograph Drug | 15 sections |
| G-Con-X | HUMAN OTC DRUG LABEL | 2 | 43913-405 | LIQUID | 1 mg | ORAL | OTC MONOGRAPH FINAL | 15 sections |
| BionatussDXP | HUMAN OTC DRUG LABEL | 3 | 45737-210 | LIQUID | 2 mg | ORAL | OTC Monograph Drug | 10 sections |
| BIO-CNEX | HUMAN OTC DRUG LABEL | 2 | 45737-239 | LIQUID | 1 mg | ORAL | OTC Monograph Drug | 9 sections |
| Biogesic | HUMAN OTC DRUG LABEL | 2 | 45737-610 | TABLET | 1 mg | ORAL | OTC Monograph Drug | 9 sections |
| Chlo Hist | HUMAN OTC DRUG LABEL | 2 | 50090-3998 | LIQUID | 1 mg | ORAL | OTC monograph final | 15 sections |
| DURATUSSDM | HUMAN OTC DRUG LABEL | 3 | 50991-142 | LIQUID | 1 mg | ORAL | OTC Monograph Drug | 16 sections |
| Duratuss AC | HUMAN OTC DRUG LABEL | 2 | 50991-540 | LIQUID | 1 mg | ORAL | OTC Monograph Drug | 14 sections |
| ALA-HIST IR | HUMAN OTC DRUG LABEL | 1 | 50991-783 | TABLET | 2 mg | ORAL | OTC Monograph Drug | 13 sections |
| Alahist CF | HUMAN OTC DRUG LABEL | 3 | 50991-784 | TABLET | 2 g | ORAL | OTC monograph final | 10 sections |
| Alahist PE | HUMAN OTC DRUG LABEL | 2 | 50991-788 | TABLET | 2 mg | ORAL | OTC Monograph Drug | 15 sections |
| Durahist | HUMAN OTC DRUG LABEL | 2 | 50991-865 | TABLET | 2 mg | ORAL | OTC Monograph Drug | 16 sections |
| SUPRESS A | HUMAN OTC DRUG LABEL | 3 | 52083-057 | SYRUP | 1 mg | ORAL | OTC monograph final | 14 sections |
| SUPRESS A | HUMAN OTC DRUG LABEL | 3 | 52083-057 | SYRUP | 1 mg | ORAL | OTC monograph final | 14 sections |
| Dologen | HUMAN OTC DRUG LABEL | 2 | 52083-481 | TABLET | 2 mg | ORAL | OTC monograph final | 10 sections |
| Dologen 325 | HUMAN OTC DRUG LABEL | 2 | 52083-482 | TABLET | 1 mg | ORAL | OTC monograph final | 10 sections |
| DOLOGEN | HUMAN OTC DRUG LABEL | 2 | 52083-483 | TABLET | 2 mg | ORAL | OTC Monograph Drug | 11 sections |
| G-Dologen | HUMAN OTC DRUG LABEL | 2 | 52083-681 | TABLET | 2 mg | ORAL | OTC monograph final | 10 sections |
| G-DOLOGEN | HUMAN OTC DRUG LABEL | 2 | 52083-683 | TABLET | 2 mg | ORAL | OTC Monograph Drug | 11 sections |
| DologesicNF | HUMAN OTC DRUG LABEL | 2 | 54859-001 | TABLET | 1 mg | ORAL | OTC Monograph Drug | 10 sections |
| DologesicDF | HUMAN OTC DRUG LABEL | 2 | 54859-010 | TABLET | 1 mg | ORAL | OTC Monograph Drug | 10 sections |
| Conex | HUMAN OTC DRUG LABEL | 2 | 54859-702 | TABLET | 2 mg | ORAL | OTC Monograph Drug | 12 sections |
| Conex | HUMAN OTC DRUG LABEL | 2 | 54859-802 | LIQUID | 1 mg | ORAL | OTC Monograph Drug | 10 sections |
| Conex Pediatric | HUMAN OTC DRUG LABEL | 2 | 54859-803 | LIQUID | 1 mg | ORAL | OTC Monograph Drug | 10 sections |