Molecule Details
InChIKeyXNEOAXKYJADVSI-UHFFFAOYSA-N
Compound NameSoRI 8897
Canonical SMILESCOc1ccc(C(F)(F)F)cc1NCc1cnc2nc(N)nc(N)c2c1C
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.47
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P00374 DHFR Homo sapiens Human PF00186 8.6 IC50 ChEMBL;BindingDB
O30463 folA Mycobacterium avium Pathogen PF00186 9.2 IC50 ChEMBL
Q07422 Toxoplasma gondii Pathogen PF00186 PF00303 7.7 IC50 ChEMBL;BindingDB