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Attributes

UniProt ID
Protein Name
Tyrosine-protein kinase JAK1
Ligand Name
2-[4-[8-oxidanylidene-2-[(~{E})-(2-oxidanylidenepyridin-3-ylidene)amino]-7~{H}-purin-9-yl]cyclohexyl]ethanenitrile
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JCBSNZZSUFHWSE-UGHOIBRWSA-N
SMILES
c1c2c(nc(n1)N=C3C=CC=NC3=O)N(C(=O)N2)C4CCC(CC4)CC#N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 6HZU
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Color Legend
Unassigned regionsLigand / hetero atomse6hzuA1e6hzuB1
ECOD domains from experimental PDB structures interacting with ligand GYQ
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P23458n/aGYQ6hzue6hzuA1A:853-1154
P23458n/aGYQ6hzue6hzuB1B:865-1154