Ligand name: 7-amino-2-tert-butyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrido[2,3-d]pyrimidine-6-carboxamide
PDB ligand accession: 3BD
DrugBank: DB07043
PubChem: 25023707
ChEMBL: n/a
InChI Key: CKLCIJCZOIDJQU-UHFFFAOYSA-N
SMILES: CC(C)(C)c1nc2c(cc(c(n2)N)C(=O)N)c(n1)N3CCN(CC3)c4ncccn4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein Q837V6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3BAB	Download	Experimental	e3babA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot