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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 = 'BDBM50124120'   
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


(Rattus norvegicus (rat))
BDBM50124120
PNG
(2-[2-chloro-6-(methylamino)-9H-purin-9-yl]-4-fluor...)
Show SMILES CNc1nc(Cl)nc2n(cnc12)C1OC(CO)C(F)C1O
Show InChI InChI=1/C11H13ClFN5O3/c1-14-8-6-9(17-11(12)16-8)18(3-15-6)10-7(20)5(13)4(2-19)21-10/h3-5,7,10,19-20H,2H2,1H3,(H,14,16,17)
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PC cid
PC sid
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Similars

Article
PubMed
1.71E+4n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]PIA from Adenosine A1 receptor in rat brain membrane


Bioorg Med Chem Lett 13: 817-20 (2003)


Article DOI: 10.1016/s0960-894x(03)00027-1
BindingDB Entry DOI: 10.7270/Q2M32WB7
More data for this
Ligand-Target Pair