Molecule Details
InChIKeyMDMSJUTXKFAZPC-UHFFFAOYSA-N
Compound Name[1-(1-Benzyl-2-{2-hydroxy-2-[3-(3-trifluoromethyl-phenoxy)-phenyl]-ethylcarbamoyl}-2-oxo-ethylcarbamoyl)-3-methyl-butyl]-carbamic acid benzyl ester
Canonical SMILESCC(C)CC(NC(=O)OCc1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)C(=O)NCC(O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL6.54
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P07384 CAPN1 Homo sapiens Human PF01067 PF13833 PF00648 6.7 Ki ChEMBL;BindingDB
P17655 CAPN2 Homo sapiens Human PF01067 PF13833 PF00648 6.3 Ki ChEMBL;BindingDB