Molecule Details
InChIKeyBCXQZFAVVLDMBN-ZLOGYFEASA-N
Compound Name6-Amino-18-(4-aminobutyl)-9,24-dibenzyl-12-(4-hydroxybenzyl)-21-(1-hydroxyethyl)-15-[1-(2-naphthyl)ethyl]-7,10,13,16,19,22,25-heptaoxo-3,4-dithia-8,11,14,17,20,23,26-heptaazacyclohexacosane-1-carboxylic acid
Canonical SMILESC[C@@H](O)[C@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H]([C@@H](C)c2ccc3ccccc3c2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](N)CSSC[C@@H](C(=O)O)NC(=O)[C@H](Cc2ccccc2)NC1=O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)5
Pfam Stratification Homologous
Avg pChEMBL7.78
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (5)
Target Gene Organism Category Pfam pChEMBL Type Source
P31391 SSTR4 Homo sapiens Human PF00001 9.3 IC50 ChEMBL;BindingDB
P30874 SSTR2 Homo sapiens Human PF00001 7.9 IC50 ChEMBL;BindingDB
P32745 SSTR3 Homo sapiens Human PF00001 7.8 IC50 ChEMBL;BindingDB
P35346 SSTR5 Homo sapiens Human PF00001 7.6 IC50 ChEMBL;BindingDB
P30872 SSTR1 Homo sapiens Human PF00001 6.3 IC50 ChEMBL;BindingDB