Molecule Details
InChIKeyOUYSLNGQLIIZQC-XZOQPEGZSA-N
Compound Name(3S,4R)-3-[[[3,5-bis(trifluoromethyl)phenyl]-methylcarbamoyl]-methylamino]-4-(4-fluorophenyl)-N-(oxan-4-yl)pyrrolidine-1-carboxamide
Canonical SMILESCN(C(=O)N(C)[C@@H]1CN(C(=O)NC2CCOCC2)C[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.94
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P25103 TACR1 Homo sapiens Human PF00001 10.4 IC50 ChEMBL;BindingDB
P21452 TACR2 Homo sapiens Human PF00001 7.2 IC50 ChEMBL;BindingDB
P29371 TACR3 Homo sapiens Human PF00001 6.2 IC50 ChEMBL;BindingDB