Molecule Details
InChIKeyXMPNZDWSSQEZEJ-HNKPZJSLSA-N
Compound Name(3R)-1-[(1S,2S)-4,6-dichloro-1-[4-(3,5-dimethyl-1,2,4-triazol-4-yl)-2-fluorophenoxy]-2,3-dihydro-1H-inden-2-yl]pyrrolidin-3-ol
Canonical SMILESCc1nnc(C)n1-c1ccc(O[C@H]2c3cc(Cl)cc(Cl)c3C[C@@H]2N2CC[C@@H](O)C2)c(F)c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.69
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P48764 SLC9A3 Homo sapiens Human PF00999 7.5 IC50 ChEMBL;BindingDB
Q14940 SLC9A5 Homo sapiens Human PF00999 6.5 IC50 ChEMBL;BindingDB
P11712 CYP2C9 Homo sapiens Human PF00067 6.0 IC50 ChEMBL;BindingDB