Ligand name: 2-[({3-tert-butyl-4-[(methylamino)methyl]-1H-pyrazol-1-yl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
PDB ligand accession: O26
DrugBank: n/a
PubChem: 46870038
ChEMBL: CHEMBL1234888
InChI Key: ORJNBGRVTFLPLF-UHFFFAOYSA-N
SMILES: CC(C)(C)c1c(cn(n1)CC(=O)Nc2c(c3c(s2)CCCC3)C(=O)N)CNC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Thiophenes
      • Subclass: Thiophene carboxylic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P19491

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3O6I	Download	Experimental	e3o6iA1 e3o6iA2	Periplasmic binding protein-like II Periplasmic binding protein-like II	LigPlot