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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50294523'   
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 A1


(Homo sapiens (Human))
BDBM50294523
PNG
(2-amino-6-(furan-2-yl)-N-(furan-2-ylmethyl)pyrimid...)
Show SMILES Nc1nc(cc(n1)-c1ccco1)C(=O)NCc1ccco1
Show InChI InChI=1S/C14H12N4O3/c15-14-17-10(12-4-2-6-21-12)7-11(18-14)13(19)16-8-9-3-1-5-20-9/h1-7H,8H2,(H,16,19)(H2,15,17,18)
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Similars

Article
PubMed
214n/an/an/an/an/an/an/an/a



Vernalis (R+D) Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]CGS21680 from human adenosine A1 receptor


Bioorg Med Chem Lett 19: 2664-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.142
BindingDB Entry DOI: 10.7270/Q2RF5V1M
More data for this
Ligand-Target Pair