Molecule Details
InChIKeyXBLYYDDTTORRLT-QFFDILLMSA-N
Canonical SMILESCn1nc(S(N)(=O)=O)s/c1=N\C(=O)CN(CCN(CCN(CC(=O)O)CC(=O)/N=c1/sc(S(N)(=O)=O)nn1C)CC(=O)O)CC(=O)O
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)4
Pfam Stratification Cross-Family
Avg pChEMBL8.38
SourceChEMBL;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (4)
Target Gene Organism Category Pfam pChEMBL Type Source
P18505 GABRB1 Homo sapiens Human PF02931 PF02932 9.4 pIC50 TTD_MultiTarget
P00918 CA2 Homo sapiens Human PF00194 8.8 Ki ChEMBL
P22748 CA4 Homo sapiens Human PF00194 8.1 Ki ChEMBL
P00915 CA1 Homo sapiens Human PF00194 7.3 Ki ChEMBL