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BDBM50404094 CHEMBL336517

SMILES: Clc1ccccc1CNCC12CC3CC(CC(C3)C1)C2

InChI Key: InChIKey=DGIPDOBNBPBNJQ-UHFFFAOYSA-N

Data: 1 Kd

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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 = 50404094   
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))		BDBM50404094
PNG
(CHEMBL336517)
Show SMILES Clc1ccccc1CNCC12CC3CC(CC(C3)C1)C2 |TLB:13:14:18:12.11.17,THB:11:10:12.13.17:15,11:12:10.18.19:15,13:12:18:14.19.15|
Show InChI InChI=1S/C18H24ClN/c19-17-4-2-1-3-16(17)11-20-12-18-8-13-5-14(9-18)7-15(6-13)10-18/h1-4,13-15,20H,5-12H2
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 3.98E+3n/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Antagonist activity at P2X7 receptor in human THP1 cells assessed as inhibition of BzATP-induced ethidium 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