Ligand name: 2-[3-[2,6-bis(fluoranyl)-4-(1~{H}-pyrazol-4-yl)phenyl]-3-oxidanylidene-propyl]-4-(1-methylpyrazol-4-yl)benzoic acid
PDB ligand accession: D60
DrugBank: n/a
PubChem: 146035892
ChEMBL: n/a
InChI Key: NNCTWMTXMLKLDE-UHFFFAOYSA-N
SMILES: Cn1cc(cn1)c2ccc(c(c2)CCC(=O)c3c(cc(cc3F)c4c[nH]nc4)F)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Linear 1,3-diarylpropanoids
      • Subclass: Chalcones and dihydrochalcones

List of PDB structures and/or AlphaFold models with target protein Q96EP0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6KC6	Download	Experimental	e6kc6A1 e6kc6A2 e6kc6I2 e6kc6C1 e6kc6C2 e6kc6K2 e6kc6E1 e6kc6E2 e6kc6G1 e6kc6G2 e6kc6A2 e6kc6I1 e6kc6I2 e6kc6C1 e6kc6K1 e6kc6K2	E3 ligase HOIP C-terminal domain RING/U-box-like RING/U-box-like RING/U-box-like E3 ligase HOIP C-terminal domain RING/U-box-like RING/U-box-like E3 ligase HOIP C-terminal domain RING/U-box-like E3 ligase HOIP C-terminal domain RING/U-box-like E3 ligase HOIP C-terminal domain RING/U-box-like RING/U-box-like E3 ligase HOIP C-terminal domain RING/U-box-like	LigPlot