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SMILES: Nc1nc(nc(NCC2CC2)c1Br)-n1cccn1

InChI Key: InChIKey=NVURDYXPWZOTGE-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 128305   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM128305
PNG
(US8796284, 29)
Show SMILES Nc1nc(nc(NCC2CC2)c1Br)-n1cccn1
Show InChI InChI=1S/C11H13BrN6/c12-8-9(13)16-11(18-5-1-4-15-18)17-10(8)14-6-7-2-3-7/h1,4-5,7H,2-3,6H2,(H3,13,14,16,17)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
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Similars

US Patent
10 -10.9n/an/an/an/an/an/a25



Palobiofarma, S.L.

US Patent


Assay Description
Competition assays were carried out by incubation of membranes from hA1 receptors transfected to CHO cells, [3H]-DPCPX as radioligand, buffer (HEPES ...


US Patent US8796284 (2014)


BindingDB Entry DOI: 10.7270/Q2WM1C2Q
More data for this
Ligand-Target Pair