Molecule Details
InChIKeyOEIXJPAIZADICN-JHOUSYSJSA-N
Compound Name[(2R,3S)-2-(3,4-dimethoxyphenyl)-5,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl] 4-fluoro-3-[(3,4,5-trimethoxybenzoyl)amino]benzoate
Canonical SMILESCOc1cc(OC)c2c(c1)O[C@H](c1ccc(OC)c(OC)c1)[C@@H](OC(=O)c1ccc(F)c(NC(=O)c3cc(OC)c(OC)c(OC)c3)c1)C2
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.51
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P08183 ABCB1 Homo sapiens Human PF00664 PF00005 8.7 IC50 ChEMBL;BindingDB
Q9UNQ0 ABCG2 Homo sapiens Human PF01061 PF19055 PF00005 7.3 IC50 ChEMBL;BindingDB
P33527 ABCC1 Homo sapiens Human PF00664 PF00005 PF24357 6.5 IC50 ChEMBL;BindingDB