Molecule Details
InChIKeyRLICCWOKSVSSOF-UHFFFAOYSA-N
Compound Name3-{4-Amino-7-[1-hydroxymethyl-2-(4-methoxy-phenyl)-ethyl]-7H-pyrrolo[2,3-d]pyrimidin-5-yl}-phenol
Canonical SMILESCOc1ccc(CC(CO)n2cc(-c3cccc(O)c3)c3c(N)ncnc32)cc1
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)5
Pfam Stratification Cross-Family
Avg pChEMBL6.47
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (5)
Target Gene Organism Category Pfam pChEMBL Type Source
P00519 ABL1 Homo sapiens Human PF08919 PF07714 PF00017 PF00018 6.5 IC50 ChEMBL;BindingDB
P18505 GABRB1 Homo sapiens Human PF02931 PF02932 6.5 pIC50 TTD_MultiTarget
P42684 ABL2 Homo sapiens Human PF08919 PF07714 PF00017 PF00018 6.5 IC50 ChEMBL
P00533 EGFR Homo sapiens Human PF00757 PF14843 PF07714 PF01030 PF21314 Clinical TTD_MultiTarget TTD_MultiTarget
P12931 SRC Homo sapiens Human PF07714 PF00017 PF00018 Clinical TTD_MultiTarget TTD_MultiTarget