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SMILES: CC(CN1CCN(CC1)c1ncccn1)NC(=O)c1cc(oc1-c1ccccc1)-c1ccccc1

InChI Key: InChIKey=OHFZZALJMWQCIT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50415595   
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 3


(RAT)		BDBM50415595
PNG
(CHEMBL602338)
Show SMILES CC(CN1CCN(CC1)c1ncccn1)NC(=O)c1cc(oc1-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C28H29N5O2/c1-21(20-32-15-17-33(18-16-32)28-29-13-8-14-30-28)31-27(34)24-19-25(22-9-4-2-5-10-22)35-26(24)23-11-6-3-7-12-23/h2-14,19,21H,15-18,20H2,1H3,(H,31,34)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Roche Palo Alto

Curated by ChEMBL


Assay Description
Antagonist activity at rat P2X3 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 1031-6 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.044
BindingDB Entry DOI: 10.7270/Q22V2HCR
More data for this
Ligand-Target Pair