Attributes
UniProt ID
Protein Name
Probable transcriptional regulatory protein
Ligand Name
4,4,4-trifluoro-1-(3-phenyl-1-oxa-2,8-diazaspiro[4.5]dec-2-en-8-yl)butan-1-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IBVDSAFESRHIBV-UHFFFAOYSA-N
SMILES
c1ccc(cc1)C2=NOC3(C2)CCN(CC3)C(=O)CCC(F)(F)F
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5ICJ
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Color Legend
Unassigned regionsLigand / hetero atomse5icjA1e5icjA2e5icjB1e5icjB2
ECOD domains from experimental PDB structures interacting with ligand 69Y
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| O53623 | n/a | 69Y | 5icj | e5icjA1 | A:12-79 |
| O53623 | n/a | 69Y | 5icj | e5icjA2 | A:83-201 |
| O53623 | n/a | 69Y | 5icj | e5icjB1 | B:83-201 |
| O53623 | n/a | 69Y | 5icj | e5icjB2 | B:12-79 |
| O53623 | n/a | 69Y | 5n7o | e5n7oA1 | A:83-201 |
| O53623 | n/a | 69Y | 5n7o | e5n7oA2 | A:11-79 |
| O53623 | n/a | 69Y | 5n7o | e5n7oB1 | B:83-201 |
| O53623 | n/a | 69Y | 5n7o | e5n7oB2 | B:11-79 |