Molecule Details
InChIKeyLBJKDVWECYXKJZ-UHFFFAOYSA-N
Compound NameN-(2-methyl-4-(5-(2-(4-(4-(pyrrolidin-1-yl)piperidine-1-carbonyl)phenylamino)pyrimidin-4-yl)thiophen-2-yl)butan-2-yl)acetamide
Canonical SMILESCC(=O)NC(C)(C)CCc1ccc(-c2ccnc(Nc3ccc(C(=O)N4CCC(N5CCCC5)CC4)cc3)n2)s1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.22
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
O14920 IKBKB Homo sapiens Human PF18397 PF12179 PF00069 6.5 IC50 ChEMBL;BindingDB
O15111 CHUK Homo sapiens Human PF18397 PF12179 PF00069 6.1 IC50 ChEMBL
Q9Y6K9 IKBKG Homo sapiens Human PF16516 PF11577 PF18414 6.1 IC50 ChEMBL