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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 = 'BDBM50189808'   
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))
BDBM50189808
PNG
(4-acetamido-2-(4-methoxyphenyl)-1,2-dihydro-1,2,4-...)
Show SMILES COc1ccc(cc1)-n1nc2c(NC(C)=O)nc3ccccc3n2c1=O
Show InChI InChI=1S/C18H15N5O3/c1-11(24)19-16-17-21-23(12-7-9-13(26-2)10-8-12)18(25)22(17)15-6-4-3-5-14(15)20-16/h3-10H,1-2H3,(H,19,20,24)
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PC cid
PC sid
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Similars

Article
PubMed
35.7n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells


J Med Chem 49: 3916-25 (2006)


Article DOI: 10.1021/jm060373w
BindingDB Entry DOI: 10.7270/Q25H7FW1
More data for this
Ligand-Target Pair