Molecule Details
InChIKeyFJDDSMSDZHURBJ-UHFFFAOYSA-N
Compound Name2-Iodomelatonin
Canonical SMILESCOc1ccc2[nH]c(I)c(CCNC(C)=O)c2c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL9.39
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB08190
Drug NameN-[2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl]acetamide
CAS Numbernan
Groups experimental
ATC Codes nan
Descriptionnan

Cross-references: BindingDB: 29611 ChEBI: 109558 CHEMBL289233 ChemSpider: 103191 Guide to Pharmacology: 1343 IUPHAR: 1343 PDB: ML2 PubChem:115348 PubChem:99444661 ZINC: ZINC000002516056
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P48039 MTNR1A Homo sapiens Human PF00001 10.2 Ki ChEMBL;BindingDB
P49286 MTNR1B Homo sapiens Human PF00001 9.8 Ki ChEMBL;BindingDB
P16083 NQO2 Homo sapiens Human PF02525 8.2 Ki ChEMBL;BindingDB
DrugBank Target Actions (3)
Target Gene Target Name Action Type
P48039 MTNR1A Melatonin receptor type 1A agonist targets
P16083 NQO2 Ribosyldihydronicotinamide dehydrogenase [quinone] inhibitor targets
P49286 MTNR1B Melatonin receptor type 1B inhibitor targets