Molecule Details
InChIKeyOMMDNOFGZYPJCA-GCDXOJGYSA-N
Compound Name3-Cyano-2-methoxy-naphthalene-1-carboxylic acid {2-(3,4-dichloro-phenyl)-4-[4-(2-methanesulfinyl-phenyl)-piperidin-1-yl]-butyl}-methyl-amide
Canonical SMILESCOc1c(C#N)cc2ccccc2c1C(=O)N(C)C[C@@H](CCN1CCC(c2ccccc2[S@+](C)[O-])CC1)c1ccc(Cl)c(Cl)c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.87
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 9.8 Ki ChEMBL;BindingDB
P21452 TACR2 Homo sapiens Human PF00001 7.2 Ki ChEMBL;BindingDB
P29371 TACR3 Homo sapiens Human PF00001 6.7 Ki ChEMBL;BindingDB