DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Spastin
Ligand Name
N-(3-tert-butyl-1H-pyrazol-5-yl)-2-[(2R)-2-methylpiperazin-1-yl]quinazolin-4-amine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NPABSCSMTWXIFP-CYBMUJFWSA-N
SMILES
CC1CNCCN1c2nc3ccccc3c(n2)Nc4cc(n[nH]4)C(C)(C)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 6NYV
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 atomse6nyvB1e6nyvB2
ECOD domains from experimental PDB structures interacting with ligand LBD
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q8I0P1n/aLBD6nyve6nyvB1B:651-755
Q8I0P1n/aLBD6nyve6nyvB2B:460-651