DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
deleted
Ligand Name
(5R)-3-ethyl-4-hydroxy-5-methyl-5-[(1E)-2-methylbuta-1,3-dien-1-yl]thiophen-2(5H)-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JXKINNHBIPAUJR-ABZNLYFFSA-N
SMILES
CCC1=C(C(SC1=O)(C)C=C(C)C=C)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4C6Z
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Color Legend
Unassigned regionsLigand / hetero atomse4c6zA1e4c6zA2e4c6zB1e4c6zB2
ECOD domains from experimental PDB structures interacting with ligand TLE
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
I6Y8T4n/aTLE4c6ze4c6zA1A:3-259
I6Y8T4n/aTLE4c6ze4c6zA2A:260-416
I6Y8T4n/aTLE4c6ze4c6zB1B:3-259
I6Y8T4n/aTLE4c6ze4c6zB2B:260-416