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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'P2X purinoceptor 3' and Ligand = 'BDBM50563053'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
P2X purinoceptor 3


(Homo sapiens (Human))
BDBM50563053
PNG
(CHEMBL4749540)
Show SMILES COc1ccc(Cn2c(Nc3cccc(c3)C(F)(F)F)nc(=O)n(CC=C)c2=O)cc1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at P2X3 receptor (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128384
BindingDB Entry DOI: 10.7270/Q2S46WTX
More data for this
Ligand-Target Pair
P2X purinoceptor 3


(Homo sapiens (Human))
BDBM50563053
PNG
(CHEMBL4749540)
Show SMILES COc1ccc(Cn2c(Nc3cccc(c3)C(F)(F)F)nc(=O)n(CC=C)c2=O)cc1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human P2X3 receptor expressed in rat C6-BU-1 cells


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.127833
BindingDB Entry DOI: 10.7270/Q2V40ZXF
More data for this
Ligand-Target Pair