Ligand name: Pralsetinib
PDB ligand accession: Q4J
DrugBank: DB15822
InChI Key: GBLBJPZSROAGMF-BATDWUPUSA-N
SMILES: Cc1cc(n[nH]1)Nc2cc(nc(n2)C3CCC(CC3)(C(=O)NC(C)c4ccc(nc4)n5cc(cn5)F)OC)C
Drug action: inhibitor

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q16288

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
Q16288	Download	Predicted	Q16288_F1_nD4	Protein kinase/SAICAR synthase/ATP-grasp
1WWC		Predicted	e1wwcA1
3V5Q		Predicted	e3v5qA1 e3v5qB2
4YMJ		Predicted	e4ymjA1 e4ymjB1
6KZC		Predicted	e6kzcA1
6KZD		Predicted	e6kzdA1