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BDBM50306703 ((2R,3S,4R,5R)-3,4-dihydroxy-5-(6-methoxy-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate::CHEMBL602071

SMILES: COc1cc(=O)[nH]c(=O)n1[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O

InChI Key: InChIKey=JNLLOPLLQNKAIF-XCBZGROMSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50306703   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Purinergic receptor P2Y2


(Homo sapiens (Human))
BDBM50306703
PNG
(((2R,3S,4R,5R)-3,4-dihydroxy-5-(6-methoxy-2,4-diox...)
Show SMILES COc1cc(=O)[nH]c(=O)n1[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C10H17N2O16P3/c1-24-6-2-5(13)11-10(16)12(6)9-8(15)7(14)4(26-9)3-25-30(20,21)28-31(22,23)27-29(17,18)19/h2,4,7-9,14-15H,3H2,1H3,(H,20,21)(H,22,23)(H,11,13,16)(H2,17,18,19)/t4-,7-,8-,9-/m1/s1
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Similars

Article
PubMed
n/an/an/an/a 3.00E+3n/an/an/an/a



Bar-Ilan University

Curated by ChEMBL


Assay Description
Agonist activity at human P2Y2 receptor expressed in human 1321N1 cells assessed as calcium elevation by fura2/AM assay


J Med Chem 53: 1673-85 (2010)


Article DOI: 10.1021/jm901450d
BindingDB Entry DOI: 10.7270/Q2ZW1MWR
More data for this
Ligand-Target Pair