Ligand name: 5-[[6-chloranyl-5-(1-methylindol-5-yl)-1H-benzimidazol-2-yl]oxy]-2-methyl-benzoic acid
PDB ligand accession: 992
DrugBank: n/a
PubChem: 45256693
ChEMBL: CHEMBL3393127
InChI Key: FHWSAZXFPUMKFL-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1C(=O)O)Oc2[nH]c3cc(c(cc3n2)c4ccc5c(c4)ccn5C)Cl
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Ethers

List of PDB structures and/or AlphaFold models with target protein P54646

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4CFE	Download	Experimental	e4cfeB1 e4cfeA1 e4cfeD1 e4cfeC2	Immunoglobulin-like beta-sandwich Protein kinase/SAICAR synthase/ATP-grasp Immunoglobulin-like beta-sandwich Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
5ISO	Download	Experimental	e5isoB2 e5isoA1 e5isoC1 e5isoD2 e5isoA2	Immunoglobulin-like beta-sandwich Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp Immunoglobulin-like beta-sandwich TBP-like	LigPlot