Molecule Details
InChIKeyDYSYUHAHEWMCMM-UHFFFAOYSA-N
Compound NameUS11530198, Example 98
Canonical SMILESNc1ncc(N2CCN(c3cccc(-c4cnc(N5CCC5)nc4)c3)CC2)c(N)n1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL7.08
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P00374 DHFR Homo sapiens Human PF00186 6.0 IC50 ChEMBL;BindingDB
Q07422 Toxoplasma gondii Pathogen PF00186 PF00303 8.1 IC50 BindingDB