Molecule Details
InChIKeyVAHFPFWYMCULAM-HWLDZIHSSA-N
Compound Name(2R,3R,4S,5R,6R)-N-(1,3-benzothiazol-6-yl)-4-[4-(4-bromo-2,3-difluorophenyl)triazol-1-yl]-5-hydroxy-6-(hydroxymethyl)-3-methoxy-N-methyloxane-2-carboxamide
Canonical SMILESCO[C@@H]1[C@@H](n2cc(-c3ccc(Br)c(F)c3F)nn2)[C@@H](O)[C@@H](CO)O[C@H]1C(=O)N(C)c1ccc2ncsc2c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Cross-Family
Avg pChEMBL7.82
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P17931 LGALS3 Homo sapiens Human PF00337 7.8 IC50 ChEMBL;BindingDB
P29375 KDM5A Homo sapiens Human PF01388 PF02373 PF02375 PF21323 PF00628 PF08429 PF02928 7.8 IC50 BindingDB