Molecule Details
InChIKeyKZEWGAHUIUQCHU-MYHRABSESA-N
Compound Name(5R,8S,11S,14S)-14-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)-8,11-dibenzyl-7,10,13-trioxo-1,3-dithia-6,9,12-triazacyclopentadecane-5-carboxamide
Canonical SMILESNC(=O)[C@@H]1CSCSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL9.38
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P35372 OPRM1 Homo sapiens Human PF00001 10.8 Ki ChEMBL;BindingDB
P41143 OPRD1 Homo sapiens Human PF00001 8.7 Ki ChEMBL;BindingDB
P41145 OPRK1 Homo sapiens Human PF00001 8.6 Ki ChEMBL;BindingDB