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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A3' and Ligand = 'BDBM50137536'   
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
Adenosine receptor A3


(Homo sapiens (Human))
BDBM50137536
PNG
(CHEMBL3753384)
Show SMILES C1CCC(CC1)Nc1nc(NC2CCCCC2)n2nc(nc2n1)-c1ccco1
Show InChI InChI=1S/C20H27N7O/c1-3-8-14(9-4-1)21-18-24-19(22-15-10-5-2-6-11-15)27-20(25-18)23-17(26-27)16-12-7-13-28-16/h7,12-15H,1-6,8-11H2,(H2,21,22,23,24,25,26)
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PC sid
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Similars

Article
PubMed
129n/an/an/an/an/an/an/an/a



Universit£ di Trieste

Curated by ChEMBL


Assay Description
Displacement of [3H]HEMADO from human A3 adenosine receptor expressed in CHO cell membranes


Eur J Med Chem 108: 529-41 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.019
BindingDB Entry DOI: 10.7270/Q22R3THM
More data for this
Ligand-Target Pair