DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Tyrosine-protein phosphatase non-receptor type 11
Ligand Name
6-[(3S,4S)-4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl]-3-[3-chloro-2-(cyclopropylamino)pyridin-4-yl]-5-methyl-2,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
URUPFUYPXLMTMT-KPZWWZAWSA-N
SMILES
CC1C(C2(CCN(CC2)C3=Nc4c(c([nH]n4)c5ccnc(c5Cl)NC6CC6)C(=O)N3C)CO1)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 6MDC
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 atomse6mdcA1e6mdcA2e6mdcA3e6mdcB1e6mdcB2e6mdcB3
ECOD domains from experimental PDB structures interacting with ligand JEA
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q06124n/aJEA6mdce6mdcA1A:110-218
Q06124n/aJEA6mdce6mdcA2A:219-525
Q06124n/aJEA6mdce6mdcA3A:4-110
Q06124n/aJEA6mdce6mdcB1B:219-525
Q06124n/aJEA6mdce6mdcB2B:4-110
Q06124n/aJEA6mdce6mdcB3B:110-218