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SMILES: Oc1cccc(CCn2ccnc2-c2ccc(cc2)N2c3ccc4ccccc4c3NC(=O)CC2=O)c1

InChI Key: InChIKey=VLHKUWCDAMPMTP-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 365827   
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
P2X purinoceptor 4


(Homo sapiens (Human))		BDBM365827
PNG
(US9873683, Example 27)
Show SMILES Oc1cccc(CCn2ccnc2-c2ccc(cc2)N2c3ccc4ccccc4c3NC(=O)CC2=O)c1
Show InChI InChI=1S/C30H24N4O3/c35-24-6-3-4-20(18-24)14-16-33-17-15-31-30(33)22-8-11-23(12-9-22)34-26-13-10-21-5-1-2-7-25(21)29(26)32-27(36)19-28(34)37/h1-13,15,17-18,35H,14,16,19H2,(H,32,36)
KEGG

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n/an/a 78n/an/an/an/an/an/a



Duquesne University



Assay Description
The 1321N1 cells stably expressing human P2X4 receptor were seeded on a 96-well plate, cultured under the conditions of 37° C. and 5% CO2 for 24 hour...

J Med Chem 51: 68-76 (2008)


BindingDB Entry DOI: 10.7270/Q2MW2KFS
More data for this
Ligand-Target Pair