Ligand name: (S)-N-(1-(3-CHLORO-4-FLUOROPHENYL)-2-HYDROXYETHYL)-4-(4-(3-CHLOROPHENYL)-1H-PYRAZOL-3-YL)-1H-PYRROLE-2-CARBOXAMIDE
PDB ligand accession: 82A
DrugBank: DB07264
PubChem: 135449326
ChEMBL: CHEMBL387385
InChI Key: YMUYGRBBEDYUOP-HXUWFJFHSA-N
SMILES: c1cc(cc(c1)Cl)c2c[nH]nc2c3cc([nH]c3)C(=O)NC(CO)c4ccc(c(c4)Cl)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Azoles
      • Subclass: Pyrazoles

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P28482

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2OJJ	Download	Experimental	e2ojjA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot