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Attributes

UniProt ID
Protein Name
N-lysine methyltransferase SMYD2
Ligand Name
6-[2-[4-[2-(3,4-dichlorophenyl)ethyl]piperazin-1-yl]phenyl]-~{N}-(3-pyrrolidin-1-ylpropyl)-2~{H}-pyrazolo[3,4-b]pyridine-4-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
UYKVPOQVUKTFDL-UHFFFAOYSA-N
SMILES
c1ccc(c(c1)c2cc(c3c[nH]nc3n2)C(=O)NCCCN4CCCC4)N5CCN(CC5)CCc6ccc(c(c6)Cl)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 5KJM
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Color Legend
Unassigned regionsLigand / hetero atomse5kjmA1e5kjmA2
ECOD domains from experimental PDB structures interacting with ligand 6TM
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q9NRG4n/a6TM5kjme5kjmA2A:5-270