Ligand name: (2R)-{1-[{7-[2-({[3-(dimethylamino)propyl](methyl)amino}methyl)-1,3-thiazol-4-yl]-4-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl}(oxo)acetyl]piperidin-4-yl}(phenyl)acetonitrile
PDB ligand accession: JYV
DrugBank: n/a
PubChem: 137349624
ChEMBL: CHEMBL5171580
InChI Key: SZUBSUMMJMHMJF-DEOSSOPVSA-N
SMILES: CN(C)CCCN(C)Cc1nc(cs1)c2c3c(c(c[nH]3)C(=O)C(=O)N4CCC(CC4)C(C#N)c5ccccc5)c(cn2)OC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolopyridines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q2N0S6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6MU6	Download	Experimental	e6mu6G1 e6mu6G2 e6mu6G3	Ribosomal protein L31e-like V1/V2 domain in HIV gp120 gp120 inner domain	LigPlot