Molecule Details
InChIKeyZQSAQSCGHSOXTE-SUHOFRIBSA-N
Compound Name(2R,3R,4S,5R,6R)-N-(1,3-benzothiazol-6-yl)-4-[4-(4-bromo-3,5-difluorophenyl)triazol-1-yl]-5-hydroxy-6-(hydroxymethyl)-3-methoxy-N-methyloxane-2-carboxamide
Canonical SMILESCO[C@@H]1[C@@H](n2cc(-c3cc(F)c(Br)c(F)c3)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 pChEMBL7.4
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 7.4 IC50 ChEMBL
P29375 KDM5A Homo sapiens Human PF01388 PF02373 PF02375 PF21323 PF00628 PF08429 PF02928 7.4 IC50 BindingDB