Molecule Details
InChIKeyUMVYPFAJDLQOIO-JWZKTCGFSA-N
Compound Name(S)-3-[(1S,3R)-3-(4-Cyano-4-phenyl-piperidin-1-yl)-cyclopentylcarbamoyl]-4-(3,4-difluoro-phenyl)-6-methoxymethyl-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid methyl ester
Canonical SMILESCOCC1=C(C(=O)OC)[C@H](c2ccc(F)c(F)c2)N(C(=O)N[C@H]2CC[C@@H](N3CCC(C#N)(c4ccccc4)CC3)C2)C(=O)N1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL6.98
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P35348 ADRA1A Homo sapiens Human PF00001 8.6 Ki ChEMBL;BindingDB
P25100 ADRA1D Homo sapiens Human PF00001 6.2 Ki ChEMBL;BindingDB
P35368 ADRA1B Homo sapiens Human PF00001 6.1 Ki ChEMBL;BindingDB