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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A2a' and Ligand = 'BDBM50051228'   
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 A2a


(Rattus norvegicus (rat))
BDBM50051228
PNG
(2-Furan-2-yl-7-(2-morpholin-4-yl-ethyl)-7H-pyrazol...)
Show SMILES Nc1nc2n(CCN3CCOCC3)ncc2c2nc(nn12)-c1ccco1
Show InChI InChI=1S/C16H18N8O2/c17-16-20-14-11(10-18-23(14)4-3-22-5-8-25-9-6-22)15-19-13(21-24(15)16)12-2-1-7-26-12/h1-2,7,10H,3-6,8-9H2,(H2,17,20)
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MMDB

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PC sid
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Similars

Article
PubMed
5.60n/an/an/an/an/an/an/an/a



Università degli Studi di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CGS- 21680 binding to Adenosine A2A receptor in rat striatal homogenates.


J Med Chem 39: 1164-71 (1996)


Article DOI: 10.1021/jm950746l
BindingDB Entry DOI: 10.7270/Q2NP23H4
More data for this
Ligand-Target Pair