Molecule Details
InChIKeyPPHTXRNHTVLQED-UHFFFAOYSA-N
Compound NameLixivaptan
Canonical SMILESCc1ccc(F)cc1C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)c(Cl)c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.19
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB06666
Drug NameLixivaptan
CAS Number168079-32-1
Groups investigational
ATC Codes nan
Descriptionnan
Categories: Acids, Carbocyclic Amides Benzazepines Benzene Derivatives Benzoates Heterocyclic Compounds, Fused-Ring
Cross-references: BindingDB: 50065115 CHEMBL49429 ChemSpider: 151067 Wikipedia: Lixivaptan ZINC: ZINC000000600399
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P30518 AVPR2 Homo sapiens Human PF00001 8.5 IC50 ChEMBL;BindingDB
P37288 AVPR1A Homo sapiens Human PF00001 PF08983 6.8 IC50 ChEMBL;BindingDB
P30559 OXTR Homo sapiens Human PF00001 6.3 IC50 ChEMBL;BindingDB
DrugBank Target Actions (2)
Target Gene Target Name Action Type
P30518 AVPR2 Vasopressin V2 receptor antagonist targets
P19113 P19113 Histidine decarboxylase inhibitor targets