Ligand name: 5-fluoranyl-2-[5-[[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]amino]-[1,2,3]triazolo[4,5-d]pyrimidin-3-yl]benzenecarbonitrile
PDB ligand accession: OXW
DrugBank: n/a
PubChem: 89720345
ChEMBL: CHEMBL4757911
InChI Key: AWEOBSGKFWBFJW-UHFFFAOYSA-N
SMILES: CN1CCC(CC1)n2cc(cn2)Nc3ncc4c(n3)n(nn4)c5ccc(cc5C#N)F
Drug action: n/a

ClassyFire chemical classification:

List of PDB structures and/or AlphaFold models with target protein Q16659

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
6YLC Download Experimental e6ylcA1
e6ylcC1
e6ylcB1
e6ylcC1
e6ylcD1
e6ylcD1
Protein kinase/SAICAR synthase/ATP-grasp
Protein kinase/SAICAR synthase/ATP-grasp
Protein kinase/SAICAR synthase/ATP-grasp
Protein kinase/SAICAR synthase/ATP-grasp
Protein kinase/SAICAR synthase/ATP-grasp
Protein kinase/SAICAR synthase/ATP-grasp
LigPlot