Molecule Details
InChIKeyGTBLQVSIEGDPPV-UHFFFAOYSA-N
Compound NameCyp1B1-IN-1
Canonical SMILESO=c1cc(-c2cccc(Cl)c2)oc2c1ccc1ccccc12
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.24
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q16678 CYP1B1 Homo sapiens Human PF00067 9.3 IC50 ChEMBL;BindingDB
P04798 CYP1A1 Homo sapiens Human PF00067 8.3 IC50 ChEMBL;BindingDB
P05177 CYP1A2 Homo sapiens Human PF00067 7.1 IC50 ChEMBL;BindingDB