Ligand name: 4-{(Z)-2-[6-chloro-1-(4-fluorobenzyl)-1H-indol-3-yl]-1-cyanoethenyl}benzoic acid
PDB ligand accession: 4NY
DrugBank: n/a
PubChem: 91936956
ChEMBL: n/a
InChI Key: KOJRGZHWAHYXMU-YBFXNURJSA-N
SMILES: c1cc(ccc1Cn2cc(c3c2cc(cc3)Cl)C=C(C#N)c4ccc(cc4)C(=O)O)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: N-alkylindoles

List of PDB structures and/or AlphaFold models with target protein Q13822

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4ZG6	Download	Experimental	e4zg6A5 e4zg6A6 e4zg6B4 e4zg6B6	Somatomedin B domain Alkaline phosphatase-like Somatomedin B domain Alkaline phosphatase-like	LigPlot