Ligand name: 3-[6-(aminomethyl)-1-(2-hydroxyethyl)-1H-indol-3-yl]benzene-1-carbothioamide
PDB ligand accession: UK7
DrugBank: n/a
PubChem: 132137133
ChEMBL: CHEMBL4546073
InChI Key: CIMSFIOQZTXZEP-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)C(=S)N)c2cn(c3c2ccc(c3)CN)CCO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrroles
      • Subclass: Substituted pyrroles

List of PDB structures and/or AlphaFold models with target protein Q9NR48

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6X0P	Download	Experimental	e6x0pA1 e6x0pB2 e6x0pC2 e6x0pD1	beta-clip beta-clip beta-clip beta-clip	LigPlot