Molecule Details
InChIKeyKBDZMHUBIGWJPD-UHFFFAOYSA-N
Compound Name2-(4-((1h-1,2,4-Triazol-1-yl)methyl)-5-(4-bromophenyl)-1-(2,4-dichlorophenyl)-1h-pyrazol-3-yl)-5-tert-butyl-1,3,4-thiadiazole
Canonical SMILESCC(C)(C)c1nnc(-c2nn(-c3ccc(Cl)cc3Cl)c(-c3ccc(Br)cc3)c2Cn2cncn2)s1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL7.84
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P11712 CYP2C9 Homo sapiens Human PF00067 8.6 IC50 ChEMBL;BindingDB
P05177 CYP1A2 Homo sapiens Human PF00067 8.6 IC50 ChEMBL;BindingDB
P34972 CNR2 Homo sapiens Human PF00001 6.4 IC50 ChEMBL;BindingDB