DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Genome polyprotein
Ligand Name
1-(2,4-difluorobenzyl)-6-{[3-(trifluoromethyl)pyridin-2-yl]oxy}quinazolin-4(1H)-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
SWXDHFLZCMRYEP-UHFFFAOYSA-N
SMILES
c1cc(c(nc1)Oc2ccc3c(c2)C(=O)N=CN3Cc4ccc(cc4F)F)C(F)(F)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 4JJU
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse4jjuA3e4jjuA4e4jjuB3e4jjuB4
ECOD domains from experimental PDB structures interacting with ligand 1MB
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
O92972n/a1MB4jjue4jjuA4A:354-563
O92972n/a1MB4jjue4jjuB4B:354-563