Ligand name: 1-ethyl-3-[1-(pyridin-2-yl)-6-(pyridin-3-yl)-1H-pyrrolo[3,2-b]pyridin-3-yl]urea
PDB ligand accession: 57W
DrugBank: n/a
PubChem: 92045130
ChEMBL: CHEMBL3736222
InChI Key: FRDSIJNIQUPVHU-UHFFFAOYSA-N
SMILES: CCNC(=O)Nc1cn(c2c1ncc(c2)c3cccnc3)c4ccccn4
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P0A0K8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5D7C	Download	Experimental	e5d7cA1 e5d7cB1	ATPase domain of HSP90 chaperone/DNA topoisomerase II/histidine kinase-like ATPase domain of HSP90 chaperone/DNA topoisomerase II/histidine kinase-like	LigPlot