DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Tyrosine-protein kinase JAK2
Ligand Name
(3R)-3-cyclopentyl-3-[4-(2-{[4-(piperidin-4-yl)phenyl]amino}-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]propanenitrile
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
RGIJZWRVCBSGJV-RUZDIDTESA-N
SMILES
c1cc(ccc1C2CCNCC2)Nc3nc(c4cc[nH]c4n3)c5cnn(c5)C(CC#N)C6CCCC6
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 6VNC
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Color Legend
Unassigned regionsLigand / hetero atomse6vncA1e6vncB1
ECOD domains from experimental PDB structures interacting with ligand R6V
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
O60674n/aR6V6vnce6vncA1A:835-1131
O60674n/aR6V6vnce6vncB1B:843-1131
O60674n/aR6V6vs3e6vs3A1A:843-1131
O60674n/aR6V6vs3e6vs3B1B:835-1132