Molecule Details
InChIKeyMKYDARKRDSXKSS-ZCSDQBEYSA-N
Compound Name2-[[(1S,2S,6R,14R,16R)-5-(cyclopropylmethyl)-11-hydroxy-15-methoxy-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11-trien-16-yl]methylcarbamoyl]benzoic acid
Canonical SMILESCOC12CC[C@@]3(C[C@@H]1CNC(=O)c1ccccc1C(=O)O)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.83
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P41145 OPRK1 Homo sapiens Human PF00001 9.5 Ki ChEMBL;BindingDB
P35372 OPRM1 Homo sapiens Human PF00001 8.8 Ki ChEMBL;BindingDB
P41143 OPRD1 Homo sapiens Human PF00001 8.2 Ki ChEMBL;BindingDB