Ligand name: 1-{5-[2-chloro-5-(hydroxymethyl)phenyl]pyridin-2-yl}piperidine-4-carboxylic acid
PDB ligand accession: 4VN
DrugBank: n/a
PubChem: 119025597
ChEMBL: n/a
InChI Key: ZHEDDGBFOGXDOY-UHFFFAOYSA-N
SMILES: c1cc(c(cc1CO)c2ccc(nc2)N3CCC(CC3)C(=O)O)Cl
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Phenylpyridines

List of PDB structures and/or AlphaFold models with target protein C1CIR8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5BQS	Download	Experimental	e5bqsA1 e5bqsA2 e5bqsA1 e5bqsB2 e5bqsA2 e5bqsB3	Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like	LigPlot