Molecule Details
InChIKeyXXMAAHCJSQLUJD-LSYYVWMOSA-N
Canonical SMILESC[C@@]1(C(=O)N[C@@H](Cc2ccc(-c3cccc(C#N)c3)cc2)C(=O)O)CCCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Cross-Family
Avg pChEMBL8.96
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P13612 ITGA4 Homo sapiens Human PF01839 PF08441 PF20805 PF20806 9.0 IC50 ChEMBL;BindingDB
P05556 ITGB1 Homo sapiens Human PF07974 PF23105 PF18372 PF08725 PF07965 PF00362 PF17205 8.9 IC50 ChEMBL