Ligand name: 2-{4-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-3-METHYLTHIOPHEN-2-YL}ETHYL TRIHYDROGEN DIPHOSPHATE
PDB ligand accession: TPW
DrugBank: n/a
PubChem: 10364977
ChEMBL: CHEMBL1236381
InChI Key: IOGGWTLVIZLGGZ-UHFFFAOYSA-N
SMILES: Cc1c(csc1CCOP(=O)(O)OP(=O)(O)O)Cc2cnc(nc2N)C

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organic oxoanionic compounds
      • Subclass: Organic pyrophosphates

List of proteins that are targets for TPW

#	DrugDomain Data	UniProt Accession	Protein name	Drug Action	Affinity data
1	P21873_TPW	P21873	Pyruvate dehydrogenase E1	n/a
2	P21874_TPW	P21874	Pyruvate dehydrogenase E1	n/a
3	P51852_TPW	P51852	Indole-3-pyruvate decarboxylase (Indolepyruvate	n/a
4	P40149_TPW	P40149	Oxalyl-CoA decarboxylase (EC	n/a
5	P0DUV9_TPW	P0DUV9	2-hydroxyacyl-CoA lyase (AcHACL)	n/a