Molecule Details
InChIKeyOMKLMGOTDGZEAD-CQJMVLFOSA-N
Compound NameHydroxylethylamine scaffold 57
Canonical SMILESCc1cc(C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)[C@@H](O)CN[C@@H](Cc2ccc(Br)cc2)C(N)=O)C(C)C)c(C(F)(F)F)o1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL6.46
SourceBindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P07339 CTSD Homo sapiens Human PF07966 PF00026 6.2 Ki BindingDB
P39898 PMI Plasmodium falciparum (isolate HB3) Pathogen PF00026 6.9 Ki BindingDB
P46925 PMII Plasmodium falciparum (isolate HB3) Pathogen PF00026 6.3 Ki BindingDB