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BDBM50496867 CHEMBL3220056

SMILES: O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OCCC#C)O[C@H]([C@@H]1O)n1cc\c(=N\OCc2ccccc2)[nH]c1=O

InChI Key: InChIKey=LTKKGIQRAKNART-NXWXRZEISA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50496867   
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
Pyrimidinergic receptor P2Y6


(Homo sapiens (Human))		BDBM50496867
PNG
(CHEMBL3220056)
Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OCCC#C)O[C@H]([C@@H]1O)n1cc\c(=N\OCc2ccccc2)[nH]c1=O |r|
Show InChI InChI=1S/C20H26N3O15P3/c1-2-3-11-34-39(27,28)37-41(31,32)38-40(29,30)35-13-15-17(24)18(25)19(36-15)23-10-9-16(21-20(23)26)22-33-12-14-7-5-4-6-8-14/h1,4-10,15,17-19,24-25H,3,11-13H2,(H,27,28)(H,29,30)(H,31,32)(H,21,22,26)/t15-,17-,18-,19-/m1/s1
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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 1.75E+3n/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant P2Y6 receptor expressed in human 1321N1 cells using [3H]inositol as substrate assessed as [3H]inositol phosphat...

Medchemcomm 4: 1156-1165 (2013)


Article DOI: 10.1039/c3md00132f
BindingDB Entry DOI: 10.7270/Q20G3P36
More data for this
Ligand-Target Pair