Molecule Details
InChIKeyAPKQXDMBJZPYQM-VWLOTQADSA-N
Compound NameN-[(1S)-1-[5-(2-methoxyquinolin-3-yl)-1H-imidazol-2-yl]-7-oxononyl]-8-methyl-1-oxa-2,8-diazaspiro[4.5]dec-2-ene-3-carboxamide
Canonical SMILESCCC(=O)CCCCC[C@H](NC(=O)C1=NOC2(CCN(C)CC2)C1)c1ncc(-c2cc3ccccc3nc2OC)[nH]1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.75
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q13547 HDAC1 Homo sapiens Human PF00850 9.0 IC50 ChEMBL;BindingDB
O15379 HDAC3 Homo sapiens Human PF00850 8.9 IC50 ChEMBL;BindingDB
Q92769 HDAC2 Homo sapiens Human PF00850 8.3 IC50 ChEMBL;BindingDB