BDBM333246 (2S,3R,4S)-2-(8-((4-methylpiperazin-1-yl)amino)-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)tetrahydrothiophene-3,4-diol::US10196396, Compound 41

SMILES CN1CCN(CC1)Nc1nccn2c(nnc12)[C@@H]1SC[C@@H](O)[C@H]1O

InChI Key InChIKey=MMFRGJFWQSOXIM-GMTAPVOTSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 333246   

TargetAdenosine receptor A3(Homo sapiens (Human))
Handok

US Patent
LigandPNGBDBM333246((2S,3R,4S)-2-(8-((4-methylpiperazin-1-yl)amino)-[1...)
Affinity DataKi: <10nMAssay Description:HEK-293 cell membrane homogenates (32 μg protein), in which A3 adenosine receptors were expressed, are incubated for 120 min at 22° C. with 0.15...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetAdenosine receptor A1(Homo sapiens (Human))
Handok

US Patent
LigandPNGBDBM333246((2S,3R,4S)-2-(8-((4-methylpiperazin-1-yl)amino)-[1...)
Affinity DataKi:  5.50E+3nMAssay Description:CHO cell membrane homogenates (40 μg protein), in which A1 adenosine receptors were expressed, are incubated for 60 min at 22° C. with 1 nM [3H]...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetAdenosine receptor A2a(Homo sapiens (Human))
Handok

US Patent
LigandPNGBDBM333246((2S,3R,4S)-2-(8-((4-methylpiperazin-1-yl)amino)-[1...)
Affinity DataKi:  5.50E+3nMAssay Description:HEK-293 cell membrane homogenates (40 μg protein), in which A2a adenosine receptors were expressed, are incubated for 120 min at 22° C. with 6 n...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent