Molecule Details
InChIKeyTYCYCBSPZNGACF-DEOSSOPVSA-N
Compound Name2-[4-[(2S)-2-carboxy-2-[3-[2-chloro-4-[4-(diaminomethylideneamino)benzoyl]oxyphenyl]propanoylamino]ethyl]phenoxy]-2-methylpropanoic acid
Canonical SMILESCC(C)(Oc1ccc(C[C@H](NC(=O)CCc2ccc(OC(=O)c3ccc(NC(=N)N)cc3)cc2Cl)C(=O)O)cc1)C(=O)O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL9.45
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P07477 PRSS1 Homo sapiens Human PF00089 9.7 IC50 ChEMBL;BindingDB
P07478 PRSS2 Homo sapiens Human PF00089 9.3 IC50 ChEMBL
P35030 PRSS3 Homo sapiens Human PF00089 9.3 IC50 ChEMBL