Molecule Details
InChIKeyCADNLTAFOMUWRR-PMACEKPBSA-N
Compound Name(6S,7S)-N-hydroxy-6-{[4-(3-isopropylphenyl)-3,6-dihydropyridin-1(2H)-yl]carbonyl}-5-azaspiro[2.5]octane-7-carboxamide
Canonical SMILESCC(C)c1cccc(C2=CCN(C(=O)[C@H]3NCC4(CC4)C[C@@H]3C(=O)NO)CC2)c1
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.89
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
O14672 ADAM10 Homo sapiens Human PF21299 PF00200 PF13574 6.9 IC50 ChEMBL;BindingDB
P08253 MMP2 Homo sapiens Human PF00040 PF00045 PF00413 Clinical TTD_MultiTarget TTD_MultiTarget
P18843 nadE Escherichia coli (strain K12) Pathogen PF02540 Clinical TTD_MultiTarget TTD_MultiTarget