DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Thymidylate kinase
Ligand Name
5-methyl-1-[(3S)-1-{3-[3-(trifluoromethyl)phenoxy]benzyl}piperidin-3-yl]pyrimidine-2,4(1H,3H)-dione
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
OVDFDRSJZJQKLN-IBGZPJMESA-N
SMILES
CC1=CN(C(=O)NC1=O)C2CCCN(C2)Cc3cccc(c3)Oc4cccc(c4)C(F)(F)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4HEJ
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Color Legend
Unassigned regionsLigand / hetero atomse4hejA1e4hejB1
ECOD domains from experimental PDB structures interacting with ligand 14D
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P65249n/a14D4heje4hejA1A:1-189