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BDBM50195844 ({[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-methyl-1-oxo-1,2-dihydroisoquinolin-2-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid::CHEMBL241318

SMILES: Cc1ccc2c(ccn([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]3O)c2=O)c1

InChI Key: InChIKey=ZNASYJKFOBLLDG-RGCMKSIDSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50195844   
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))
BDBM50195844
PNG
(({[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-methyl-1-ox...)
Show SMILES Cc1ccc2c(ccn([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]3O)c2=O)c1 |w:14.14,18.18|
Show InChI InChI=1S/C15H20NO14P3/c1-8-2-3-10-9(6-8)4-5-16(14(10)19)15-13(18)12(17)11(28-15)7-27-32(23,24)30-33(25,26)29-31(20,21)22/h2-6,11-13,15,17-18H,7H2,1H3,(H,23,24)(H,25,26)(H2,20,21,22)/t11-,12-,13-,15-/m1/s1
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PC sid
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Similars

Article
PubMed
n/an/an/an/a 35n/an/an/an/a



UCB-Group

Curated by ChEMBL


Assay Description
Agonist activity at human P2Y2 receptor expressed in human 1321N1 by FLIPR assay


Bioorg Med Chem Lett 17: 562-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.09.017
BindingDB Entry DOI: 10.7270/Q2CC11JS
More data for this
Ligand-Target Pair