BDBM50366413 PHOSPHOENOLPYRUVATE

SMILES: OC(=O)C(=C)OP(O)(O)=O

InChI Key: InChIKey=DTBNBXWJWCWCIK-UHFFFAOYSA-N

Data: 4 KI

PDB links: 57 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50366413   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Xaa-Pro dipeptidase (Homo sapiens (Human))	BDBM50366413 (PHOSPHOENOLPYRUVATE) Show SMILES OC(=O)C(=C)OP(O)(O)=O Show InChI InChI=1S/C3H5O6P/c1-2(3(4)5)9-10(6,7)8/h1H2,(H,4,5)(H2,6,7,8)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	Article	8.5	n/a	n/a	n/a	n/a	n/a	n/a	6.0	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of prolidase from swine kidney at a pH 6				Bioorg Med Chem Lett 5: 627-630 (1995) Article DOI: 10.1016/0960-894X(95)00085-8 BindingDB Entry DOI: 10.7270/Q2W096DZ
					More data for this Ligand-Target Pair
Xaa-Pro dipeptidase (Homo sapiens (Human))	BDBM50366413 (PHOSPHOENOLPYRUVATE) Show SMILES OC(=O)C(=C)OP(O)(O)=O Show InChI InChI=1S/C3H5O6P/c1-2(3(4)5)9-10(6,7)8/h1H2,(H,4,5)(H2,6,7,8)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	Article	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory constant for inhibition of prolidase in the first phase of biphasic inhibition				Bioorg Med Chem Lett 5: 627-630 (1995) Article DOI: 10.1016/0960-894X(95)00085-8 BindingDB Entry DOI: 10.7270/Q2W096DZ
					More data for this Ligand-Target Pair
Phosphoenolpyruvate carboxykinase, cytosolic [GTP] [H477R] (Rattus norvegicus (Rat))	BDBM50366413 (PHOSPHOENOLPYRUVATE) Show SMILES OC(=O)C(=C)OP(O)(O)=O Show InChI InChI=1S/C3H5O6P/c1-2(3(4)5)9-10(6,7)8/h1H2,(H,4,5)(H2,6,7,8)	PDB GoogleScholar AffyNet	Purchase DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	2.89E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Waterloo					Assay Description The inhibition of H477R PEPCK by β-sulfopyruvate (βSP), oxalate, and GMPPCP was conducted in the direction of PEP synthesis (OAA → PE...				Biochemistry 56: 2106-2115 (2017) Article DOI: 10.1021/acs.biochem.7b00178 BindingDB Entry DOI: 10.7270/Q2D50KTV
					More data for this Ligand-Target Pair				3D Structure (crystal)
Solute carrier organic anion transporter family member 2A1 (Homo sapiens (Human))	BDBM50366413 (PHOSPHOENOLPYRUVATE) Show SMILES OC(=O)C(=C)OP(O)(O)=O Show InChI InChI=1S/C3H5O6P/c1-2(3(4)5)9-10(6,7)8/h1H2,(H,4,5)(H2,6,7,8)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	1.30E+7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Albert Einstein College of Medicine Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of PGE2 uptake in PGT-expressing HeLa cells				Am J Physiol Renal Physiol 282: 1097-102 (2002) Article DOI: 10.1152/ajprenal.00151.2001 BindingDB Entry DOI: 10.7270/Q21V5G7C
					More data for this Ligand-Target Pair