Molecule Details
InChIKeyUTARRQKZBUCQBR-ISPDCEQMSA-N
Compound Name(6R,9S,12S,15S)-9-[3-(diaminomethylideneamino)propyl]-15-(1H-imidazol-5-ylmethyl)-6-(1H-indol-3-ylmethyl)-12-(naphthalen-2-ylmethyl)-5,8,11,14,17,20-hexaoxo-1,4,7,10,13,16-hexazacycloicosane-3-carboxamide
Canonical SMILESN=C(N)NCCC[C@@H]1NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)CCC(=O)NCC(C(N)=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC1=O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.11
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P32245 MC4R Homo sapiens Human PF00001 9.6 Ki ChEMBL;BindingDB
P41968 MC3R Homo sapiens Human PF00001 7.5 Ki ChEMBL;BindingDB
P33032 MC5R Homo sapiens Human PF00001 7.2 Ki ChEMBL;BindingDB