Ligand name: N-[5-(2-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-5-({[(3R,4R)-3-fluoropiperidin-4-yl]methyl}amino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PDB ligand accession: 1OC
DrugBank: n/a
PubChem: 71307955
ChEMBL: CHEMBL2387464
InChI Key: BEXSRDRFSVXXPU-VFNWGFHPSA-N
SMILES: c1ccc(c(c1)c2cc3c(c[nH]c3nc2)NC(=O)c4cnn5c4nc(cc5)NCC6CCNCC6F)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Phenylpyridines

List of PDB structures and/or AlphaFold models with target protein P11309

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4K1B	Download	Experimental	e4k1bA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot