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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 = 'BDBM50170947'   
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))
BDBM50170947
PNG
(2-Phenyl-2,5-dihydro-pyrazolo[4,3-c]quinoline-4-th...)
Show SMILES S=c1[nH]c2ccccc2c2nn(cc12)-c1ccccc1
Show InChI InChI=1S/C16H11N3S/c20-16-13-10-19(11-6-2-1-3-7-11)18-15(13)12-8-4-5-9-14(12)17-16/h1-10H,(H,17,20)
PDB

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PC cid
PC sid
UniChem
Article
PubMed
220n/an/an/an/an/an/an/an/a



Università di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of [3H]-MRE3008-F20 binding to human adenosine A3 receptor expressed in CHO cells; (n=3 - 6)


J Med Chem 48: 5001-8 (2005)


Article DOI: 10.1021/jm050125k
BindingDB Entry DOI: 10.7270/Q24749DW
More data for this
Ligand-Target Pair