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Compile Data Set for Download or QSAR

Found 1217 hits with Last Name = 'van vloten' and Initial = 'k'   
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 A2


(Homo sapiens (Human))
BDBM21190
PNG
(4-(2-{[5-amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-...)
Show SMILES Nc1nc(NCCc2ccc(O)cc2)nc2nc(nn12)-c1ccco1
Show InChI InChI=1S/C16H15N7O2/c17-14-20-15(18-8-7-10-3-5-11(24)6-4-10)21-16-19-13(22-23(14)16)12-2-1-9-25-12/h1-6,9,24H,7-8H2,(H3,17,18,19,20,21,22)
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0.300n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2A receptor


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173189
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES CCN(CC)C(=O)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C20H20N6O2/c1-3-25(4-2)20(27)14-8-5-7-13(11-14)15-12-26-19(17(21)22-15)23-18(24-26)16-9-6-10-28-16/h5-12H,3-4H2,1-2H3,(H2,21,22)
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1n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173176
PNG
(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)NCCc1ccc(O)cc1
Show InChI InChI=1S/C18H16N6O3/c19-15-17-22-16(14-2-1-9-27-14)23-24(17)10-13(21-15)18(26)20-8-7-11-3-5-12(25)6-4-11/h1-6,9-10,25H,7-8H2,(H2,19,21)(H,20,26)
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1n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173186
PNG
(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin...)
Show SMILES CCCCNC(=O)c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C14H16N6O2/c1-2-3-6-16-14(21)9-8-20-13(11(15)17-9)18-12(19-20)10-5-4-7-22-10/h4-5,7-8H,2-3,6H2,1H3,(H2,15,17)(H,16,21)
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1n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173201
PNG
(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C17H14N6O2/c18-14-16-21-15(13-7-4-8-25-13)22-23(16)10-12(20-14)17(24)19-9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H2,18,20)(H,19,24)
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2n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A2


(Homo sapiens (Human))
BDBM50048466
PNG
(2-(furan-2-yl)-7-phenethyl-7H-pyrazolo[4,3-e][1,2,...)
Show SMILES Nc1nc2n(CCc3ccccc3)ncc2c2nc(nn12)-c1ccco1
Show InChI InChI=1S/C18H15N7O/c19-18-22-16-13(11-20-24(16)9-8-12-5-2-1-3-6-12)17-21-15(23-25(17)18)14-7-4-10-26-14/h1-7,10-11H,8-9H2,(H2,19,22)
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2.30n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2A receptor


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173179
PNG
(CHEMBL196104 | [3-(8-Amino-2-furan-2-yl-[1,2,4]tri...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc(c1)C(=O)N1CCN(CC1)c1ccncc1
Show InChI InChI=1S/C25H22N8O2/c26-22-24-29-23(21-5-2-14-35-21)30-33(24)16-20(28-22)17-3-1-4-18(15-17)25(34)32-12-10-31(11-13-32)19-6-8-27-9-7-19/h1-9,14-16H,10-13H2,(H2,26,28)
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3n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173201
PNG
(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C17H14N6O2/c18-14-16-21-15(13-7-4-8-25-13)22-23(16)10-12(20-14)17(24)19-9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H2,18,20)(H,19,24)
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14n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173188
PNG
(CHEMBL383568 | [4-(8-Amino-2-furan-2-yl-[1,2,4]tri...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1ccc(cc1)C(=O)N1CCOCC1
Show InChI InChI=1S/C20H18N6O3/c21-17-19-23-18(16-2-1-9-29-16)24-26(19)12-15(22-17)13-3-5-14(6-4-13)20(27)25-7-10-28-11-8-25/h1-6,9,12H,7-8,10-11H2,(H2,21,22)
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19n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173200
PNG
(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin...)
Show SMILES CN(Cc1ccccc1)C(=O)c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C18H16N6O2/c1-23(10-12-6-3-2-4-7-12)18(25)13-11-24-17(15(19)20-13)21-16(22-24)14-8-5-9-26-14/h2-9,11H,10H2,1H3,(H2,19,20)
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27n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173182
PNG
(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)NCCCc1ccccc1
Show InChI InChI=1S/C19H18N6O2/c20-16-18-23-17(15-9-5-11-27-15)24-25(18)12-14(22-16)19(26)21-10-4-8-13-6-2-1-3-7-13/h1-3,5-7,9,11-12H,4,8,10H2,(H2,20,22)(H,21,26)
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28n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173192
PNG
(4-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1ccc(cc1)C(=O)NCCc1ccc(O)cc1
Show InChI InChI=1S/C24H20N6O3/c25-21-23-28-22(20-2-1-13-33-20)29-30(23)14-19(27-21)16-5-7-17(8-6-16)24(32)26-12-11-15-3-9-18(31)10-4-15/h1-10,13-14,31H,11-12H2,(H2,25,27)(H,26,32)
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36n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173189
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES CCN(CC)C(=O)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C20H20N6O2/c1-3-25(4-2)20(27)14-8-5-7-13(11-14)15-12-26-19(17(21)22-15)23-18(24-26)16-9-6-10-28-16/h5-12H,3-4H2,1-2H3,(H2,21,22)
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41n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173177
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES CN(C)C(=O)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C18H16N6O2/c1-23(2)18(25)12-6-3-5-11(9-12)13-10-24-17(15(19)20-13)21-16(22-24)14-7-4-8-26-14/h3-10H,1-2H3,(H2,19,20)
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70n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173202
PNG
(1-[3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]p...)
Show SMILES CC(=O)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C17H13N5O2/c1-10(23)11-4-2-5-12(8-11)13-9-22-17(15(18)19-13)20-16(21-22)14-6-3-7-24-14/h2-9H,1H3,(H2,18,19)
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75n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173210
PNG
(2-Furan-2-yl-6-(3-methanesulfonyl-phenyl)-[1,2,4]t...)
Show SMILES CS(=O)(=O)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C16H13N5O3S/c1-25(22,23)11-5-2-4-10(8-11)12-9-21-16(14(17)18-12)19-15(20-21)13-6-3-7-24-13/h2-9H,1H3,(H2,17,18)
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110n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173180
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES NC(=O)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C16H12N6O2/c17-13-16-20-15(12-5-2-6-24-12)21-22(16)8-11(19-13)9-3-1-4-10(7-9)14(18)23/h1-8H,(H2,17,19)(H2,18,23)
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110n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173186
PNG
(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin...)
Show SMILES CCCCNC(=O)c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C14H16N6O2/c1-2-3-6-16-14(21)9-8-20-13(11(15)17-9)18-12(19-20)10-5-4-7-22-10/h4-5,7-8H,2-3,6H2,1H3,(H2,15,17)(H,16,21)
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120n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173177
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES CN(C)C(=O)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C18H16N6O2/c1-23(2)18(25)12-6-3-5-11(9-12)13-10-24-17(15(19)20-13)21-16(22-24)14-7-4-8-26-14/h3-10H,1-2H3,(H2,19,20)
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120n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173181
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES CC(C)NC(=O)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C19H18N6O2/c1-11(2)21-19(26)13-6-3-5-12(9-13)14-10-25-18(16(20)22-14)23-17(24-25)15-7-4-8-27-15/h3-11H,1-2H3,(H2,20,22)(H,21,26)
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140n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173212
PNG
(6-(3-Dimethylamino-phenyl)-2-furan-2-yl-[1,2,4]tri...)
Show SMILES CN(C)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C17H16N6O/c1-22(2)12-6-3-5-11(9-12)13-10-23-17(15(18)19-13)20-16(21-23)14-7-4-8-24-14/h3-10H,1-2H3,(H2,18,19)
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140n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173174
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc(c1)C#N
Show InChI InChI=1S/C16H10N6O/c17-8-10-3-1-4-11(7-10)12-9-22-16(14(18)19-12)20-15(21-22)13-5-2-6-23-13/h1-7,9H,(H2,18,19)
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160n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173200
PNG
(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin...)
Show SMILES CN(Cc1ccccc1)C(=O)c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C18H16N6O2/c1-23(10-12-6-3-2-4-7-12)18(25)13-11-24-17(15(19)20-13)21-16(22-24)14-8-5-9-26-14/h2-9,11H,10H2,1H3,(H2,19,20)
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160n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173197
PNG
(CHEMBL370880 | N-[3-(8-Amino-2-furan-2-yl-[1,2,4]t...)
Show SMILES CC(=O)Nc1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C17H14N6O2/c1-10(24)19-12-5-2-4-11(8-12)13-9-23-17(15(18)20-13)21-16(22-23)14-6-3-7-25-14/h2-9H,1H3,(H2,18,20)(H,19,24)
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160n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173190
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc(c1)C(=O)NCCc1ccc(O)cc1
Show InChI InChI=1S/C24H20N6O3/c25-21-23-28-22(20-5-2-12-33-20)29-30(23)14-19(27-21)16-3-1-4-17(13-16)24(32)26-11-10-15-6-8-18(31)9-7-15/h1-9,12-14,31H,10-11H2,(H2,25,27)(H,26,32)
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180n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173204
PNG
(2-Furan-2-yl-6-(3-trifluoromethyl-phenyl)-[1,2,4]t...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C16H10F3N5O/c17-16(18,19)10-4-1-3-9(7-10)11-8-24-15(13(20)21-11)22-14(23-24)12-5-2-6-25-12/h1-8H,(H2,20,21)
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220n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173187
PNG
(CHEMBL194693 | [3-(8-Amino-2-furan-2-yl-[1,2,4]tri...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc(c1)C(=O)N1CCOCC1
Show InChI InChI=1S/C20H18N6O3/c21-17-19-23-18(16-5-2-8-29-16)24-26(19)12-15(22-17)13-3-1-4-14(11-13)20(27)25-6-9-28-10-7-25/h1-5,8,11-12H,6-7,9-10H2,(H2,21,22)
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240n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173182
PNG
(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)NCCCc1ccccc1
Show InChI InChI=1S/C19H18N6O2/c20-16-18-23-17(15-9-5-11-27-15)24-25(18)12-14(22-16)19(26)21-10-4-8-13-6-2-1-3-7-13/h1-3,5-7,9,11-12H,4,8,10H2,(H2,20,22)(H,21,26)
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240n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173217
PNG
(2-Furan-2-yl-6-quinolin-8-yl-[1,2,4]triazolo[1,5-a...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc2cccnc12
Show InChI InChI=1S/C18H12N6O/c19-16-18-22-17(14-7-3-9-25-14)23-24(18)10-13(21-16)12-6-1-4-11-5-2-8-20-15(11)12/h1-10H,(H2,19,21)
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250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173196
PNG
(CHEMBL194244 | [3-(8-Amino-2-furan-2-yl-[1,2,4]tri...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc(c1)C(=O)N1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C27H25N7O2/c28-24-26-30-25(23-10-5-15-36-23)31-34(26)18-22(29-24)20-8-4-9-21(16-20)27(35)33-13-11-32(12-14-33)17-19-6-2-1-3-7-19/h1-10,15-16,18H,11-14,17H2,(H2,28,29)
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>250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173193
PNG
((8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazi...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)N1CCN(CC1)c1ccncc1
Show InChI InChI=1S/C19H18N8O2/c20-16-18-23-17(15-2-1-11-29-15)24-27(18)12-14(22-16)19(28)26-9-7-25(8-10-26)13-3-5-21-6-4-13/h1-6,11-12H,7-10H2,(H2,20,22)
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>250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173175
PNG
((8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazi...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)N1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H21N7O2/c22-18-20-24-19(17-7-4-12-30-17)25-28(20)14-16(23-18)21(29)27-10-8-26(9-11-27)13-15-5-2-1-3-6-15/h1-7,12,14H,8-11,13H2,(H2,22,23)
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>250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173175
PNG
((8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazi...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)N1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C21H21N7O2/c22-18-20-24-19(17-7-4-12-30-17)25-28(20)14-16(23-18)21(29)27-10-8-26(9-11-27)13-15-5-2-1-3-6-15/h1-7,12,14H,8-11,13H2,(H2,22,23)
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>250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173187
PNG
(CHEMBL194693 | [3-(8-Amino-2-furan-2-yl-[1,2,4]tri...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc(c1)C(=O)N1CCOCC1
Show InChI InChI=1S/C20H18N6O3/c21-17-19-23-18(16-5-2-8-29-16)24-26(19)12-15(22-17)13-3-1-4-14(11-13)20(27)25-6-9-28-10-7-25/h1-5,8,11-12H,6-7,9-10H2,(H2,21,22)
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<250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173190
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc(c1)C(=O)NCCc1ccc(O)cc1
Show InChI InChI=1S/C24H20N6O3/c25-21-23-28-22(20-5-2-12-33-20)29-30(23)14-19(27-21)16-3-1-4-17(13-16)24(32)26-11-10-15-6-8-18(31)9-7-15/h1-9,12-14,31H,10-11H2,(H2,25,27)(H,26,32)
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>250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173185
PNG
((8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazi...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)N1CCOCC1
Show InChI InChI=1S/C14H14N6O3/c15-11-13-17-12(10-2-1-5-23-10)18-20(13)8-9(16-11)14(21)19-3-6-22-7-4-19/h1-2,5,8H,3-4,6-7H2,(H2,15,16)
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>250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173185
PNG
((8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazi...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)N1CCOCC1
Show InChI InChI=1S/C14H14N6O3/c15-11-13-17-12(10-2-1-5-23-10)18-20(13)8-9(16-11)14(21)19-3-6-22-7-4-19/h1-2,5,8H,3-4,6-7H2,(H2,15,16)
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>250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173183
PNG
(4-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1ccc(cc1)C(=O)NCCCn1ccnc1
Show InChI InChI=1S/C22H20N8O2/c23-19-21-27-20(18-3-1-12-32-18)28-30(21)13-17(26-19)15-4-6-16(7-5-15)22(31)25-8-2-10-29-11-9-24-14-29/h1,3-7,9,11-14H,2,8,10H2,(H2,23,26)(H,25,31)
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>250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173193
PNG
((8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazi...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)N1CCN(CC1)c1ccncc1
Show InChI InChI=1S/C19H18N8O2/c20-16-18-23-17(15-2-1-11-29-15)24-27(18)12-14(22-16)19(28)26-9-7-25(8-10-26)13-3-5-21-6-4-13/h1-6,11-12H,7-10H2,(H2,20,22)
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>250n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173211
PNG
(2-Furan-2-yl-6-(3-methoxy-phenyl)-[1,2,4]triazolo[...)
Show SMILES COc1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C16H13N5O2/c1-22-11-5-2-4-10(8-11)12-9-21-16(14(17)18-12)19-15(20-21)13-6-3-7-23-13/h2-9H,1H3,(H2,17,18)
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270n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173181
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES CC(C)NC(=O)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C19H18N6O2/c1-11(2)21-19(26)13-6-3-5-12(9-13)14-10-25-18(16(20)22-14)23-17(24-25)15-7-4-8-27-15/h3-11H,1-2H3,(H2,20,22)(H,21,26)
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290n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50173176
PNG
(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)C(=O)NCCc1ccc(O)cc1
Show InChI InChI=1S/C18H16N6O3/c19-15-17-22-16(14-2-1-9-27-14)23-24(17)10-13(21-15)18(26)20-8-7-11-3-5-12(25)6-4-11/h1-6,9-10,25H,7-8H2,(H2,19,21)(H,20,26)
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320n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A1 receptor of rat cerebral cortex using [3H]-DPCPX compared to SCH-58261 (Ki=390 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173183
PNG
(4-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1ccc(cc1)C(=O)NCCCn1ccnc1
Show InChI InChI=1S/C22H20N8O2/c23-19-21-27-20(18-3-1-12-32-18)28-30(21)13-17(26-19)15-4-6-16(7-5-15)22(31)25-8-2-10-29-11-9-24-14-29/h1,3-7,9,11-14H,2,8,10H2,(H2,23,26)(H,25,31)
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330n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173184
PNG
(2-Furan-2-yl-6-pyrimidin-5-yl-[1,2,4]triazolo[1,5-...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cncnc1
Show InChI InChI=1S/C13H9N7O/c14-11-13-18-12(10-2-1-3-21-10)19-20(13)6-9(17-11)8-4-15-7-16-5-8/h1-7H,(H2,14,17)
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360n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173213
PNG
(3-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyra...)
Show SMILES CCOC(=O)c1cccc(c1)-c1cn2nc(nc2c(N)n1)-c1ccco1
Show InChI InChI=1S/C18H15N5O3/c1-2-25-18(24)12-6-3-5-11(9-12)13-10-23-17(15(19)20-13)21-16(22-23)14-7-4-8-26-14/h3-10H,2H2,1H3,(H2,19,20)
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370n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173203
PNG
(2,6-Di-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin-8-...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1ccco1
Show InChI InChI=1S/C13H9N5O2/c14-11-13-16-12(10-4-2-6-20-10)17-18(13)7-8(15-11)9-3-1-5-19-9/h1-7H,(H2,14,15)
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400n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173178
PNG
(2-Furan-2-yl-6-naphthalen-1-yl-[1,2,4]triazolo[1,5...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc2ccccc12
Show InChI InChI=1S/C19H13N5O/c20-17-19-22-18(16-9-4-10-25-16)23-24(19)11-15(21-17)14-8-3-6-12-5-1-2-7-13(12)14/h1-11H,(H2,20,21)
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420n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173206
PNG
(2-Furan-2-yl-6-(3-nitro-phenyl)-[1,2,4]triazolo[1,...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C15H10N6O3/c16-13-15-18-14(12-5-2-6-24-12)19-20(15)8-11(17-13)9-3-1-4-10(7-9)21(22)23/h1-8H,(H2,16,17)
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460n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173195
PNG
(2-Furan-2-yl-6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccnc1
Show InChI InChI=1S/C14H10N6O/c15-12-14-18-13(11-4-2-6-21-11)19-20(14)8-10(17-12)9-3-1-5-16-7-9/h1-8H,(H2,15,17)
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460n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
Adenosine Receptors A2a (A2a)


(Rattus norvegicus (rat))
BDBM50173208
PNG
(CHEMBL371260 | [3-(8-Amino-2-furan-2-yl-[1,2,4]tri...)
Show SMILES Nc1nc(cn2nc(nc12)-c1ccco1)-c1cccc(CO)c1
Show InChI InChI=1S/C16H13N5O2/c17-14-16-19-15(13-5-2-6-23-13)20-21(16)8-12(18-14)11-4-1-3-10(7-11)9-22/h1-8,22H,9H2,(H2,17,18)
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470n/an/an/an/an/an/an/an/a



Biogen Idec, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine A2a receptor of rat brain homogenates using [3H]-ZM-241,385 compared to SCH-58261 (Ki=37 nM)


Bioorg Med Chem Lett 15: 4809-13 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.052
BindingDB Entry DOI: 10.7270/Q24Q7TJV
More data for this
Ligand-Target Pair
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