Molecule Details
InChIKeyNCZXBZJVJRJUSC-GOSISDBHSA-N
Compound Name[2-[(6~{r})-2-(3-Methylsulfonylphenyl)-6-Propan-2-Yl-4,6-Dihydropyrrolo[3,4-C]pyrazol-5-Yl]-4-(Trifluoromethyl)pyrimidin-5-Yl]methanol
Canonical SMILESCC(C)[C@@H]1c2nn(-c3cccc(S(C)(=O)=O)c3)cc2CN1c1ncc(CO)c(C(F)(F)F)n1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL7.28
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P55055 NR1H2 Homo sapiens Human PF00104 PF00105 8.2 Ki ChEMBL;BindingDB
Q13133 NR1H3 Homo sapiens Human PF00104 PF00105 7.2 Ki ChEMBL;BindingDB
P11712 CYP2C9 Homo sapiens Human PF00067 6.4 IC50 ChEMBL;BindingDB