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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'P2Y purinoceptor 2' and Ligand = 'BDBM50258427'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
P2Y purinoceptor 2


(Homo sapiens (Human))
BDBM50258427
PNG
(CHEMBL522015 | uridine5'-methylene-phosphonate)
Show SMILES O[C@@H]1[C@@H](CCP(O)(O)=O)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O |r|
Show InChI InChI=1S/C10H15N2O8P/c13-6-1-3-12(10(16)11-6)9-8(15)7(14)5(20-9)2-4-21(17,18)19/h1,3,5,7-9,14-15H,2,4H2,(H,11,13,16)(H2,17,18,19)/t5-,7-,8-,9-/m1/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 5.10E+3n/an/an/an/a



Ghent University

Curated by ChEMBL


Assay Description
Agonist activity at human P2Y2 receptor expressed in human 1321N1 cells assessed as stimulation of PLC-induced [3H]inositol phosphate production afte...


Bioorg Med Chem 20: 2304-15 (2012)


Article DOI: 10.1016/j.bmc.2012.02.012
BindingDB Entry DOI: 10.7270/Q2WM1DWW
More data for this
Ligand-Target Pair
P2Y purinoceptor 2


(Homo sapiens (Human))
BDBM50258427
PNG
(CHEMBL522015 | uridine5'-methylene-phosphonate)
Show SMILES O[C@@H]1[C@@H](CCP(O)(O)=O)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O |r|
Show InChI InChI=1S/C10H15N2O8P/c13-6-1-3-12(10(16)11-6)9-8(15)7(14)5(20-9)2-4-21(17,18)19/h1,3,5,7-9,14-15H,2,4H2,(H,11,13,16)(H2,17,18,19)/t5-,7-,8-,9-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.60E+3n/an/an/an/a



Ghent University

Curated by ChEMBL


Assay Description
Agonist activity at human P2Y2 receptor expressed in human 1321N1 cells coexpressing phospholipase C-activating G protein assessed as inositol phosph...


Bioorg Med Chem Lett 19: 3002-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.027
BindingDB Entry DOI: 10.7270/Q20K28GT
More data for this
Ligand-Target Pair