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BDBM50499841 CHEMBL3739912

SMILES: FC(F)(F)c1cccc(c1)N1CCN(CC1)c1cc(=O)[nH]c(=O)n1Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1

InChI Key: InChIKey=POVBMZMQCXRVOC-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50499841   
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 7


(Homo sapiens (Human))		BDBM50499841
PNG
(CHEMBL3739912)
Show SMILES FC(F)(F)c1cccc(c1)N1CCN(CC1)c1cc(=O)[nH]c(=O)n1Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1
Show InChI InChI=1S/C31H26F3N5O5S/c32-31(33,34)23-4-2-5-24(17-23)37-13-15-38(16-14-37)29-18-28(40)36-30(41)39(29)20-21-7-9-25(10-8-21)44-45(42,43)27-6-1-3-22-19-35-12-11-26(22)27/h1-12,17-19H,13-16,20H2,(H,36,40,41)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.14E+3n/an/an/an/an/an/a



Gwangju Institute of Science and Technology (GIST)

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in HEK293 cells assessed as inhibition of BzATP-induced ethidium ion uptake after 2 hrs

Eur J Med Chem 106: 180-93 (2015)


Article DOI: 10.1016/j.ejmech.2015.10.036
BindingDB Entry DOI: 10.7270/Q2RR227R
More data for this
Ligand-Target Pair