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BDBM50414273 CHEMBL181838

SMILES: COc1ccc(CCC2=N[C@@H]([C@@H](N2)c2ccccc2)c2ccccc2)cc1

InChI Key: InChIKey=LZDDSCGGRSKXLT-PSWAGMNNSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50414273   
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))
BDBM50414273
PNG
(CHEMBL181838)
Show SMILES COc1ccc(CCC2=N[C@@H]([C@@H](N2)c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C24H24N2O/c1-27-21-15-12-18(13-16-21)14-17-22-25-23(19-8-4-2-5-9-19)24(26-22)20-10-6-3-7-11-20/h2-13,15-16,23-24H,14,17H2,1H3,(H,25,26)/t23-,24+
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.16E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Antagonist activity at human P2X7 receptor expressed in human U373 cells assessed as inhibition of BzATP-induced Yo-Pro uptake


J Med Chem 52: 3123-41 (2009)


Article DOI: 10.1021/jm801528x
BindingDB Entry DOI: 10.7270/Q2251KDR
More data for this
Ligand-Target Pair