Molecule Details
InChIKeyNWDUSAJTSMCLKW-SNVBAGLBSA-N
Compound NameUS20240025908, Example 15
Canonical SMILESC[C@@H](Nc1ccn2ncc(OC3=NCC(C)(C)N3)c2n1)c1cc(F)cc(F)c1F
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.56
SourceBindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P04629 NTRK1 Homo sapiens Human PF13855 PF16920 PF07714 PF18613 8.1 IC50 BindingDB
P08922 ROS1 Homo sapiens Human PF00041 PF07714 8.1 IC50 BindingDB
Q9UM73 ALK Homo sapiens Human PF12810 PF00629 PF07714 6.6 IC50 BindingDB