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Attributes

UniProt ID
Protein Name
Serine/threonine-protein kinase TBK1
Ligand Name
N-(3-{[5-iodo-4-({3-[(thiophen-2-ylcarbonyl)amino]propyl}amino)pyrimidin-2-yl]amino}phenyl)pyrrolidine-1-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VAVXGGRQQJZYBL-UHFFFAOYSA-N
SMILES
c1cc(cc(c1)NC(=O)N2CCCC2)Nc3ncc(c(n3)NCCCNC(=O)c4cccs4)I
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 4JL9
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Color Legend
Unassigned regionsLigand / hetero atomse4jl9A2e4jl9A3e4jl9A4
ECOD domains from experimental PDB structures interacting with ligand BX7
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q9WUN2n/aBX74jl9e4jl9A2A:0-307
Q9WUN2n/aBX76o8ce6o8cA3A:-4-307
Q9WUN2n/aBX76o8ce6o8cB3B:-3-307