Molecule Details
InChIKeyYCEGYFYGGNMXMU-UHFFFAOYSA-N
Compound NameN-[4-[[6,7-dimethoxy-4-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]amino]quinazolin-2-yl]amino]phenyl]-N'-hydroxyoctanediamide
Canonical SMILESCOc1ccc(CN2CCC(Nc3nc(Nc4ccc(NC(=O)CCCCCCC(=O)NO)cc4)nc4cc(OC)c(OC)cc34)CC2)cc1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.37
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q9UBN7 HDAC6 Homo sapiens Human PF00850 PF02148 8.6 IC50 ChEMBL;BindingDB
O15379 HDAC3 Homo sapiens Human PF00850 7.5 IC50 ChEMBL;BindingDB
Q13547 HDAC1 Homo sapiens Human PF00850 6.0 IC50 ChEMBL;BindingDB