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BDBM50412136 CHEMBL495159

SMILES: CCCCCCC(=O)NNc1ccccc1C

InChI Key: InChIKey=YHCZXYOUQUJSAY-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50412136   
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 (P2X7)


(Rattus norvegicus (Rat))
BDBM50412136
PNG
(CHEMBL495159)
Show SMILES CCCCCCC(=O)NNc1ccccc1C
Show InChI InChI=1S/C14H22N2O/c1-3-4-5-6-11-14(17)16-15-13-10-8-7-9-12(13)2/h7-10,15H,3-6,11H2,1-2H3,(H,16,17)
PDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 195n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat recombinant P2X7 receptor expressed in human 1321N1 cells assessed as benzoyl-ATP-induced calcium flux by FLIPR assay


J Med Chem 51: 3030-4 (2008)


Article DOI: 10.1021/jm701516f
BindingDB Entry DOI: 10.7270/Q2959JR1
More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM50412136
PNG
(CHEMBL495159)
Show SMILES CCCCCCC(=O)NNc1ccccc1C
Show InChI InChI=1S/C14H22N2O/c1-3-4-5-6-11-14(17)16-15-13-10-8-7-9-12(13)2/h7-10,15H,3-6,11H2,1-2H3,(H,16,17)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 407n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant P2X7 receptor expressed in human 1321N1 cells assessed as benzoyl-ATP-induced calcium flux by FLIPR assay


J Med Chem 51: 3030-4 (2008)


Article DOI: 10.1021/jm701516f
BindingDB Entry DOI: 10.7270/Q2959JR1
More data for this
Ligand-Target Pair