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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 = 'BDBM50359571'   
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))
BDBM50359571
PNG
(CHEMBL1927666)
Show SMILES Cn1c(SCc2ccccc2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C15H16N4O2S/c1-17-11-12(18(2)15(21)19(3)13(11)20)16-14(17)22-9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
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MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
4.64E+3n/an/an/an/an/an/an/an/a



Centre of Excellence for Pharmaceutical Sciences, School of Pharmacy, North-West University, Private Bag X6001, Potchefstroom, 2520, South Africa. Electronic address: dalenevanderwalt@gmail.com.

Curated by ChEMBL


Assay Description
Displacement of [3H]CGS21680 from adenosine receptor A2a in rat brain striatal membrane


Eur J Med Chem 125: 652-656 (2017)


Article DOI: 10.1016/j.ejmech.2016.09.072
BindingDB Entry DOI: 10.7270/Q2QV3PZQ
More data for this
Ligand-Target Pair