Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 183.0 BDBM50067783Purchase

Wt: 186.0 BDBM50216218Purchase

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Phosphoglycerate kinase 1 (Homo sapiens (Human))	BDBM50216218 (3-PHOSPHOGLYCERIC ACID | 3-Phosphoglycerate | CHEB...) Show SMILES O[C@H](COP(O)(O)=O)C(O)=O |r| Show InChI InChI=1S/C3H7O7P/c4-2(3(5)6)1-10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)/t2-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	PDB PubMed	n/a	n/a	n/a	1.09E+5	n/a	n/a	n/a	n/a	n/a
University of Sheffield Curated by ChEMBL					Assay Description Dissociation constant for binding with Phosphoglycerate kinase (PGK) enzyme is evaluated				Bioorg Med Chem Lett 8: 2603-8 (1998) BindingDB Entry DOI: 10.7270/Q2QV3PP4
					More data for this Ligand-Target Pair				3D Structure (crystal)
Phosphoglycerate kinase (Saccharomyces cerevisiae)	BDBM50067783 (3-Phosphoglycerate | 3-phospho-D-glyceric acid) Show SMILES O[C@H](COP([O-])([O-])=O)C([O-])=O Show InChI InChI=1S/C3H7O7P/c4-2(3(5)6)1-10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)/p-3/t2-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.10E+5	n/a	n/a	n/a	n/a	n/a
University of Sheffield Curated by ChEMBL					Assay Description Dissociation constant of phosphoglycerate kinase (PGK) at pH (3.0-11.0) was determined				J Med Chem 41: 4439-52 (1998) Article DOI: 10.1021/jm970839y BindingDB Entry DOI: 10.7270/Q2BR8SV2
					More data for this Ligand-Target Pair