Ligand name: 1-(2-{(2S)-2-[(6-bromopyridin-2-yl)carbamoyl]-1,3-thiazolidin-3-yl}-2-oxoethyl)-1H-pyrazolo[3,4-b]pyridine-3-carboxamide
PDB ligand accession: J55
DrugBank: n/a
PubChem: 122177127
ChEMBL: CHEMBL3890777
InChI Key: AOOWOKALXAVACG-SFHVURJKSA-N
SMILES: c1cc(nc(c1)Br)NC(=O)C2N(CCS2)C(=O)Cn3c4c(cccn4)c(n3)C(=O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein P00746

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5TCA	Download	Experimental	e5tcaA1 e5tcaC1 e5tcaB1 e5tcaC1 e5tcaD1 e5tcaE1 e5tcaE1 e5tcaD1 e5tcaF1 e5tcaG1	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot