Molecule Details
InChIKeyMXYUKLILVYORSK-HBMCJLEFSA-N
Compound NameLobeline
Canonical SMILESCN1[C@@H](CC(=O)c2ccccc2)CCC[C@H]1C[C@H](O)c1ccccc1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL7.84
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB05137
Drug NameLobeline
CAS Number90-69-7
Groups investigational
ATC Codes nan
DescriptionAn alkaloid that has actions similar to nicotine on nicotinic cholinergic receptors but is less potent. It has been proposed for a variety of therapeutic uses including in respiratory disorders, peripheral vascular disorders, insomnia, and smoking cessation. [PubChem]

Categories: Alkaloids Autonomic Agents Cholinergic Agents Cholinergic Agonists Ganglionic Stimulants Neurotransmitter Agents Nicotinic Agonists Peripheral Nervous System Agents Piperidines Respiratory System Agents
Cross-references: BindingDB: 50080818 ChEBI: 48723 CHEMBL122270 ChemSpider: 91814 C07475 D02364 PDB: L0B PubChem:101616 PubChem:175426951 RxCUI: 6464 Wikipedia: Lobeline ZINC: ZINC000000001624
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P17787 CHRNB2 Homo sapiens Human PF02931 PF02932 8.3 Ki ChEMBL
P43681 CHRNA4 Homo sapiens Human PF02931 PF02932 8.3 Ki ChEMBL;BindingDB
P10635 CYP2D6 Homo sapiens Human PF00067 6.9 Ki ChEMBL
DrugBank Target Actions (4)
Target Gene Target Name Action Type
P36544 CHRNA7 Neuronal acetylcholine receptor subunit alpha-7 binder targets
Q9GZZ6 CHRNA10 Neuronal acetylcholine receptor subunit alpha-10 binder targets
Q9UGM1 CHRNA9 Neuronal acetylcholine receptor subunit alpha-9 binder targets
Q05940 SLC18A2 Synaptic vesicular amine transporter inhibitor targets