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Target
Serine/threonine-protein kinase TBK1
Ligand
BDBM397780
Substrate
n/a
Meas. Tech.
Inhibition Assay
IC50
31.6±n/a nM
Citation
 Bigi, S; Keung, W; Swann, S; Vu, PH; Woodhead, SJ; Gangloff, AR Heteroarylamide inhibitors of TBK1 US Patent  US9994547 Publication Date 6/12/2018 
Target
Name:
Serine/threonine-protein kinase TBK1
Synonyms:
NAK | NF-kappa-B-activating kinase | Protein cereblon/Serine/threonine-protein kinase TBK1 | T2K | TANK-binding kinase 1 (TBK-1) | TANK-binding kinase 1 (TBK1) | TBK1 | TBK1_HUMAN
Type:
protein
Mol. Mass.:
83645.20
Organism:
Homo sapiens (Human)
Description:
Q9UHD2
Residue:
729
Sequence:
MQSTSNHLWLLSDILGQGATANVFRGRHKKTGDLFAIKVFNNISFLRPVDVQMREFEVLKKLNHKNIVKLFAIEEETTTRHKVLIMEFCPCGSLYTVLEEPSNAYGLPESEFLIVLRDVVGGMNHLRENGIVHRDIKPGNIMRVIGEDGQSVYKLTDFGAARELEDDEQFVSLYGTEEYLHPDMYERAVLRKDHQKKYGATVDLWSIGVTFYHAATGSLPFRPFEGPRRNKEVMYKIITGKPSGAISGVQKAENGPIDWSGDMPVSCSLSRGLQVLLTPVLANILEADQEKCWGFDQFFAETSDILHRMVIHVFSLQQMTAHKIYIHSYNTATIFHELVYKQTKIISSNQELIYEGRRLVLEPGRLAQHFPKTTEENPIFVVSREPLNTIGLIYEKISLPKVHPRYDLDGDASMAKAITGVVCYACRIASTLLLYQELMRKGIRWLIELIKDDYNETVHKKTEVVITLDFCIRNIEKTVKVYEKLMKINLEAAELGEISDIHTKLLRLSSSQGTIETSLQDIDSRLSPGGSLADAWAHQEGTHPKDRNVEKLQVLLNCMTEIYYQFKKDKAERRLAYNEEQIHKFDKQKLYYHATKAMTHFTDECVKKYEAFLNKSEEWIRKMLHLRKQLLSLTNQCFDIEEEVSKYQEYTNELQETLPQKMFTASSGIKHTMTPIYPSSNTLVEMTLGMKKLKEEMEGVVKELAENNHILERFGSLTMDGGLRNVDCL
  
Inhibitor
Name:
BDBM397780
Synonyms:
(S)-N-(5-(6-cyano-5-((1-((2,2-difluoroethyl)(methyl)amino)-1-oxopropan-2-yl)amino)pyridin-3-yl)pyrazin-2-yl)-3-methoxycyclobutanecarboxamide | US9994547, Example 149
Type:
Small organic molecule
Emp. Form.:
C22H25F2N7O3
Mol. Mass.:
473.4758
SMILES:
COC1CC(C1)C(=O)Nc1cnc(cn1)-c1cnc(C#N)c(N[C@@H](C)C(=O)N(C)CC(F)F)c1 |r,wU:23.25,(-11.48,2.67,;-10.71,1.33,;-9.17,1.33,;-8.09,2.42,;-7,1.33,;-8.09,.24,;-5.46,1.33,;-4.69,,;-4.69,2.67,;-3.15,2.67,;-2.38,1.33,;-.84,1.33,;-.07,2.67,;-.84,4,;-2.38,4,;1.47,2.67,;2.24,4,;3.78,4,;4.65,2.7,;6.19,2.72,;7.72,2.73,;3.78,1.33,;4.55,,;6.09,,;6.86,1.33,;6.86,-1.33,;6.09,-2.67,;8.4,-1.33,;9.17,,;9.17,-2.67,;10.71,-2.67,;11.48,-1.33,;11.48,-4,;2.24,1.33,)|
Structure:
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