Molecule Details
InChIKeyANVBJUPKQASFMW-AEFFLSMTSA-N
Compound Name5-(4-((1-(difluoromethyl)-1H-pyrazol-4-yl)amino)-1,3,5-triazin-2-yl)-2-(((3R,4S)-3-fluoro-1-(3-hydroxypropanoyl)piperidin-4-yl)oxy)benzonitrile
Canonical SMILESN#Cc1cc(-c2ncnc(Nc3cnn(C(F)F)c3)n2)ccc1O[C@H]1CCN(C(=O)CCO)C[C@H]1F
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.75
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q9UHD2 TBK1 Homo sapiens Human PF00069 PF18394 PF18396 7.2 IC50 ChEMBL;BindingDB
Q14164 IKBKE Homo sapiens Human PF00069 PF18394 PF18396 7.0 IC50 BindingDB
O60674 JAK2 Homo sapiens Human PF18379 PF18377 PF17887 PF07714 PF21990 6.0 IC50 ChEMBL;BindingDB