Molecule Details
InChIKeyOFUFYXNPWNFQBY-MOYQKVPZSA-N
Compound Name(R)-2-[3-(1-{(R)-5-[(3,5-Dichloro-benzoyl)-methyl-amino]-3-(3,4-dichloro-phenyl)-4-[(Z)-methoxyimino]-pentyl}-piperidin-4-yl)-2-oxo-tetrahydro-pyrimidin-1-yl]-3-(4-hydroxy-phenyl)-propionic acid ethyl ester
Canonical SMILESCCOC(=O)[C@@H](Cc1ccc(O)cc1)N1CCCN(C2CCN(CC[C@@H](/C(CN(C)C(=O)c3cc(Cl)cc(Cl)c3)=N/OC)c3ccc(Cl)c(Cl)c3)CC2)C1=O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.56
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P21452 TACR2 Homo sapiens Human PF00001 8.9 Ki ChEMBL;BindingDB
P25103 TACR1 Homo sapiens Human PF00001 8.8 Ki ChEMBL;BindingDB
P29371 TACR3 Homo sapiens Human PF00001 8.0 Ki ChEMBL;BindingDB