Molecule Details
InChIKeyKWQRIWDMNAKJAF-UHFFFAOYSA-N
Compound Name2-[3-[3-(4-Methylpiperazin-1-Yl)propoxy]phenyl]-~{n}-[4-(1~{h}-Pyrrolo[2,3-B]pyridin-3-Yl)-1,3-Thiazol-2-Yl]ethanamide
Canonical SMILESCN1CCN(CCCOc2cccc(CC(=O)Nc3nc(-c4c[nH]c5ncccc45)cs3)c2)CC1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.81
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q13464 ROCK1 Homo sapiens Human PF25346 PF00069 PF08912 8.2 Ki ChEMBL;BindingDB
O14578 CIT Homo sapiens Human PF00780 PF00169 PF00069 PF00433 6.2 Ki ChEMBL;BindingDB
P36888 FLT3 Homo sapiens Human PF00047 PF07714 6.0 Ki ChEMBL;BindingDB