Molecule Details
InChIKeyNWIUTZDMDHAVTP-UHFFFAOYSA-N
Compound NameBetaxolol
Canonical SMILESCC(C)NCC(O)COc1ccc(CCOCC2CC2)cc1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.85
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB00195
Drug NameBetaxolol
CAS Number63659-18-7
Groups approved investigational
ATC Codes S01ED02 C07AB05 S01ED52
DescriptionA cardioselective beta-1-adrenergic antagonist with no partial agonist activity.

Categories: Adrenergic Agents Adrenergic Antagonists Adrenergic beta-1 Receptor Antagonists Adrenergic beta-Antagonists Agents causing hyperkalemia Alcohols Amines Amino Alcohols Antiarrhythmic agents Antiglaucoma Preparations and Miotics Antihypertensive Agents Antihypertensive Agents Indicated for Hypertension Autonomic Agents Beta Blocking Agents, Selective Beta-Blockers (Beta1 Selective) Beta-adrenergic Agents Bradycardia-Causing Agents Cardiovascular Agents Cytochrome P-450 CYP1A2 Substrates Cytochrome P-450 CYP2D6 Substrates Cytochrome P-450 Substrates Hypotensive Agents Neurotransmitter Agents Ophthalmologicals Peripheral Nervous System Agents Phenoxypropanolamines Propanolamines Propanols QTc Prolonging Agents Sensory Organs Sympatholytics
Cross-references: BindingDB: 50405521 ChEBI: 3082 CHEMBL423 ChemSpider: 2279 Drugs Product Database (DPD): 11219 Guide to Pharmacology: 549 IUPHAR: 549 C06849 PharmGKB: PA448611 PubChem:2369 PubChem:46506041 RxCUI: 1520 Therapeutic Targets Database: DAP000305 Wikipedia: Betaxolol
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P08588 ADRB1 Homo sapiens Human PF00001 7.6 IC50 ChEMBL;BindingDB
Q99720 SIGMAR1 Homo sapiens Human PF04622 6.6 Ki ChEMBL
P07550 ADRB2 Homo sapiens Human PF00001 6.4 IC50 ChEMBL
DrugBank Target Actions (4)
Target Gene Target Name Action Type
P05177 CYP1A2 Cytochrome P450 1A2 substrate enzymes
P10635 CYP2D6 Cytochrome P450 2D6 substrate enzymes
P07550 ADRB2 Beta-2 adrenergic receptor antagonist targets
P08588 ADRB1 Beta-1 adrenergic receptor antagonist targets