Molecule Details
InChIKeyGXKIGKDMKQQKJN-GYHUNEDQSA-N
Compound Name(1S,2S,13R,21R)-22-(cyclopropylmethyl)-2-hydroxy-14-oxa-11,22-diazaheptacyclo[13.9.1.0^{1,13}.0^{2,21}.0^{4,12}.0^{5,10}.0^{19,25}]pentacosa-4(12),5(10),6,8,15,17,19(25)-heptaene-16-carboxamide
Canonical SMILESNC(=O)c1ccc2c3c1O[C@H]1c4[nH]c5ccccc5c4C[C@@]4(O)[C@@H](C2)N(CC2CC2)CC[C@]314
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.0
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P41143 OPRD1 Homo sapiens Human PF00001 9.3 IC50 ChEMBL;BindingDB
P35372 OPRM1 Homo sapiens Human PF00001 7.3 Ki ChEMBL;BindingDB
P41145 OPRK1 Homo sapiens Human PF00001 7.3 Ki ChEMBL;BindingDB