Molecule Details
InChIKeyLTOXHEYDPJRTGT-UHFFFAOYSA-N
Compound Name6-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-yl)-benzothiazole-2-sulfonic acid amide
Canonical SMILESNS(=O)(=O)c1nc2ccc(N3C(=O)c4cccnc4C3=O)cc2s1
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL8.24
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P00918 CA2 Homo sapiens Human PF00194 8.4 Ki ChEMBL;BindingDB
P18505 GABRB1 Homo sapiens Human PF02931 PF02932 8.4 pIC50 TTD_MultiTarget
P00915 CA1 Homo sapiens Human PF00194 7.9 Ki ChEMBL;BindingDB