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BDBM50075404 CHEMBL3415326

SMILES: O=C1NC(=O)N(C1Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C1CCN(Cc2ccccc2)CC1

InChI Key: InChIKey=SIUBGLIPNZJSDH-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50075404   
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))
BDBM50075404
PNG
(CHEMBL3415326)
Show SMILES O=C1NC(=O)N(C1Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C1CCN(Cc2ccccc2)CC1
Show InChI InChI=1/C31H30N4O5S/c36-30-28(35(31(37)33-30)25-14-17-34(18-15-25)21-23-5-2-1-3-6-23)19-22-9-11-26(12-10-22)40-41(38,39)29-8-4-7-24-20-32-16-13-27(24)29/h1-13,16,20,25,28H,14-15,17-19,21H2,(H,33,36,37)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.62E+3n/an/an/an/an/an/a



Gwangju Institute of Science and Technology (GIST)

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human P2X7 receptor expressed in HEK293 cells assessed as inhibition of BzATP-induced intracellular ethidium bromi...


J Med Chem 58: 2114-34 (2015)


Article DOI: 10.1021/jm500324g
BindingDB Entry DOI: 10.7270/Q2H133QD
More data for this
Ligand-Target Pair