Molecule Details
InChIKeyOOSUDWRRWZVFEB-UHFFFAOYSA-N
Compound NameIsothiourea-1t
Canonical SMILESCC1(C)CN2C(CS/C(=N\C3CCCCC3)NC3CCCCC3)=CSC2=N1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Cross-Family
Avg pChEMBL6.89
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P61073 CXCR4 Homo sapiens Human PF00001 PF12109 7.4 IC50 ChEMBL;BindingDB
P10635 CYP2D6 Homo sapiens Human PF00067 6.4 IC50 ChEMBL;BindingDB