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PubMed code 21675777

Compile data set for download or QSAR
Found 139 hits of Enzyme Inhibition Constant Data   
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 A3


(Homo sapiens (Human))		BDBM50348154
PNG
(CHEMBL1800783)
Show SMILES CC[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3/t10-/m1/s1
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PubMed
 1.46n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348163
PNG
(CHEMBL1800862)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)no1
Show InChI InChI=1S/C16H18N6O3/c1-4-6-21-15-12(14-17-9(5-2)8-22(14)16(21)23)18-13(19-15)10-7-11(24-3)20-25-10/h4,7,9,17H,1,5-6,8H2,2-3H3
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 1.93n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348153
PNG
(CHEMBL1800782)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3
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 1.96n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348174
PNG
(CHEMBL1625681)
Show SMILES CC[C@@H]1Cn2c(N1)c1nc(nc1n(C)c2=O)-c1ccccc1
Show InChI InChI=1S/C16H17N5O/c1-3-11-9-21-15(17-11)12-14(20(2)16(21)22)19-13(18-12)10-7-5-4-6-8-10/h4-8,11,17H,3,9H2,1-2H3/t11-/m1/s1
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 2.30n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant A3 adenosine receptor by radioligand binding assay

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348152
PNG
(CHEMBL1800781)
Show SMILES COc1cc(-c2nc3c4NC(C)Cn4c(=O)n(CC=C)c3n2)n(C)n1
Show InChI InChI=1S/C16H19N7O2/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)10-7-11(25-4)20-21(10)3/h5,7,9,17H,1,6,8H2,2-4H3
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 2.36n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348155
PNG
(CHEMBL1800784)
Show SMILES CC[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3/t10-/m0/s1
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 2.37n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348157
PNG
(CHEMBL1800786)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)/t12-/m1/s1
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 2.38n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348158
PNG
(CHEMBL1800787)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)/t12-/m0/s1
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 2.52n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348164
PNG
(CHEMBL1800863)
Show SMILES COc1cc(on1)-c1nc2N(Cc3ccccc3)C(=O)N3CC(C)N=C3c2[nH]1 |c:26|
Show InChI InChI=1S/C19H18N6O3/c1-11-9-24-17(20-11)15-18(22-16(21-15)13-8-14(27-2)23-28-13)25(19(24)26)10-12-6-4-3-5-7-12/h3-8,11H,9-10H2,1-2H3,(H,21,22)
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 2.68n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348165
PNG
(CHEMBL1800864)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)no1 |c:5|
Show InChI InChI=1S/C20H20N6O3/c1-3-13-11-26-18(21-13)16-19(23-17(22-16)14-9-15(28-2)24-29-14)25(20(26)27)10-12-7-5-4-6-8-12/h4-9,13H,3,10-11H2,1-2H3,(H,22,23)
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 2.71n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348147
PNG
(CHEMBL1800736)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
Show InChI InChI=1S/C17H21N7O/c1-5-7-23-16-13(15-18-11(6-2)9-24(15)17(23)25)19-14(20-16)12-8-10(3)21-22(12)4/h5,8,11,18H,1,6-7,9H2,2-4H3
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 3.01n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348156
PNG
(CHEMBL1800785)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4CC(C)N=C4c3[nH]2)n(C)n1 |c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)
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 3.11n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348162
PNG
(CHEMBL1800861)
Show SMILES COc1cc(on1)-c1nc2c3NC(C)Cn3c(=O)n(CC=C)c2n1
Show InChI InChI=1S/C15H16N6O3/c1-4-5-20-14-11(13-16-8(2)7-21(13)15(20)22)17-12(18-14)9-6-10(23-3)19-24-9/h4,6,8,16H,1,5,7H2,2-3H3
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 3.58n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348159
PNG
(CHEMBL1800788)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)nn1C |c:5|
Show InChI InChI=1S/C21H23N7O2/c1-4-14-12-28-19(22-14)17-20(27(21(28)29)11-13-8-6-5-7-9-13)24-18(23-17)15-10-16(30-3)25-26(15)2/h5-10,14H,4,11-12H2,1-3H3,(H,23,24)
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 3.85n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348144
PNG
(CHEMBL1800733)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3
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 4.56n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348145
PNG
(CHEMBL1800734)
Show SMILES C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3/t10-/m1/s1
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 5.04n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348146
PNG
(CHEMBL1800735)
Show SMILES C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3/t10-/m0/s1
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 6.03n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348172
PNG
(CHEMBL1800796)
Show SMILES C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1 |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3/t9-/m0/s1
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 9.20n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348149
PNG
(CHEMBL1800738)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)
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 10.3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348173
PNG
(CHEMBL1800797)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(Cc1ccccc1)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C20H21N7O/c1-12-10-26-18(21-12)16-19(23-17(22-16)15-9-13(2)25(3)24-15)27(20(26)28)11-14-7-5-4-6-8-14/h4-9,12,21H,10-11H2,1-3H3
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 12.2n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348171
PNG
(CHEMBL1800795)
Show SMILES C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1 |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3/t9-/m1/s1
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 12.2n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348170
PNG
(CHEMBL1800794)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C17H21N7O/c1-5-7-23-16-13(15-18-11(6-2)9-24(15)17(23)25)19-14(20-16)12-8-10(3)22(4)21-12/h5,8,11,18H,1,6-7,9H2,2-4H3
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 12.5n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348150
PNG
(CHEMBL1800739)
Show SMILES CC[C@@H]1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |r,c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)/t15-/m1/s1
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 12.6n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348151
PNG
(CHEMBL1800740)
Show SMILES CC[C@H]1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |r,c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)/t15-/m0/s1
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 13.2n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348169
PNG
(CHEMBL1800793)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3
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 13.9n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348161
PNG
(CHEMBL1800798)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(Cc1ccccc1)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)26(3)25-16)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15,22H,4,11-12H2,1-3H3
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 15n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348148
PNG
(CHEMBL1800737)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |c:4|
Show InChI InChI=1S/C20H21N7O/c1-12-9-15(25(3)24-12)17-22-16-18-21-13(2)10-26(18)20(28)27(19(16)23-17)11-14-7-5-4-6-8-14/h4-9,13H,10-11H2,1-3H3,(H,22,23)
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 17.2n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348166
PNG
(CHEMBL1800790)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(CC=C)C2=O)-c1cc(OCc2ccccc2)nn1C |c:5|
Show InChI InChI=1S/C23H25N7O2/c1-4-11-29-22-19(21-24-16(5-2)13-30(21)23(29)31)25-20(26-22)17-12-18(27-28(17)3)32-14-15-9-7-6-8-10-15/h4,6-10,12,16H,1,5,11,13-14H2,2-3H3,(H,25,26)
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 21.5n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348160
PNG
(CHEMBL1800789)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(CC=C)C2=O)-c1cc(OCc2ccccc2)nn1C |c:4|
Show InChI InChI=1S/C22H23N7O2/c1-4-10-28-21-18(20-23-14(2)12-29(20)22(28)30)24-19(25-21)16-11-17(26-27(16)3)31-13-15-8-6-5-7-9-15/h4-9,11,14H,1,10,12-13H2,2-3H3,(H,24,25)
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 24.7n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348168
PNG
(CHEMBL1800792)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OCc2ccccc2)nn1C |c:5|
Show InChI InChI=1S/C27H27N7O2/c1-3-20-16-34-25(28-20)23-26(33(27(34)35)15-18-10-6-4-7-11-18)30-24(29-23)21-14-22(31-32(21)2)36-17-19-12-8-5-9-13-19/h4-14,20H,3,15-17H2,1-2H3,(H,29,30)
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 39.8n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348167
PNG
(CHEMBL1800791)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OCc2ccccc2)nn1C |c:4|
Show InChI InChI=1S/C26H25N7O2/c1-17-14-32-24(27-17)22-25(33(26(32)34)15-18-9-5-3-6-10-18)29-23(28-22)20-13-21(30-31(20)2)35-16-19-11-7-4-8-12-19/h3-13,17H,14-16H2,1-2H3,(H,28,29)
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 44.8n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]MRE 3008F20 from human adenosine A3 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348159
PNG
(CHEMBL1800788)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)nn1C |c:5|
Show InChI InChI=1S/C21H23N7O2/c1-4-14-12-28-19(22-14)17-20(27(21(28)29)11-13-8-6-5-7-9-13)24-18(23-17)15-10-16(30-3)25-26(15)2/h5-10,14H,4,11-12H2,1-3H3,(H,23,24)
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 405n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348165
PNG
(CHEMBL1800864)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)no1 |c:5|
Show InChI InChI=1S/C20H20N6O3/c1-3-13-11-26-18(21-13)16-19(23-17(22-16)14-9-15(28-2)24-29-14)25(20(26)27)10-12-7-5-4-6-8-12/h4-9,13H,3,10-11H2,1-2H3,(H,22,23)
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 485n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348147
PNG
(CHEMBL1800736)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
Show InChI InChI=1S/C17H21N7O/c1-5-7-23-16-13(15-18-11(6-2)9-24(15)17(23)25)19-14(20-16)12-8-10(3)21-22(12)4/h5,8,11,18H,1,6-7,9H2,2-4H3
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 515n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348151
PNG
(CHEMBL1800740)
Show SMILES CC[C@H]1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |r,c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)/t15-/m0/s1
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 545n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348149
PNG
(CHEMBL1800738)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)
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 615n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348150
PNG
(CHEMBL1800739)
Show SMILES CC[C@@H]1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |r,c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)/t15-/m1/s1
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 803n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348155
PNG
(CHEMBL1800784)
Show SMILES CC[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3/t10-/m0/s1
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 1.08E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348166
PNG
(CHEMBL1800790)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(CC=C)C2=O)-c1cc(OCc2ccccc2)nn1C |c:5|
Show InChI InChI=1S/C23H25N7O2/c1-4-11-29-22-19(21-24-16(5-2)13-30(21)23(29)31)25-20(26-22)17-12-18(27-28(17)3)32-14-15-9-7-6-8-10-15/h4,6-10,12,16H,1,5,11,13-14H2,2-3H3,(H,25,26)
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 1.20E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348163
PNG
(CHEMBL1800862)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)no1
Show InChI InChI=1S/C16H18N6O3/c1-4-6-21-15-12(14-17-9(5-2)8-22(14)16(21)23)18-13(19-15)10-7-11(24-3)20-25-10/h4,7,9,17H,1,5-6,8H2,2-3H3
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 1.52E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348153
PNG
(CHEMBL1800782)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3
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 1.53E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348168
PNG
(CHEMBL1800792)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OCc2ccccc2)nn1C |c:5|
Show InChI InChI=1S/C27H27N7O2/c1-3-20-16-34-25(28-20)23-26(33(27(34)35)15-18-10-6-4-7-11-18)30-24(29-23)21-14-22(31-32(21)2)36-17-19-12-8-5-9-13-19/h4-14,20H,3,15-17H2,1-2H3,(H,29,30)
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 1.68E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348158
PNG
(CHEMBL1800787)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)/t12-/m0/s1
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 1.73E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348156
PNG
(CHEMBL1800785)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4CC(C)N=C4c3[nH]2)n(C)n1 |c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)
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 1.90E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348146
PNG
(CHEMBL1800735)
Show SMILES C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3/t10-/m0/s1
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 1.96E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348167
PNG
(CHEMBL1800791)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OCc2ccccc2)nn1C |c:4|
Show InChI InChI=1S/C26H25N7O2/c1-17-14-32-24(27-17)22-25(33(26(32)34)15-18-9-5-3-6-10-18)29-23(28-22)20-13-21(30-31(20)2)35-16-19-11-7-4-8-12-19/h3-13,17H,14-16H2,1-2H3,(H,28,29)
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 2.01E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348144
PNG
(CHEMBL1800733)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3
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 2.04E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348168
PNG
(CHEMBL1800792)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OCc2ccccc2)nn1C |c:5|
Show InChI InChI=1S/C27H27N7O2/c1-3-20-16-34-25(28-20)23-26(33(27(34)35)15-18-10-6-4-7-11-18)30-24(29-23)21-14-22(31-32(21)2)36-17-19-12-8-5-9-13-19/h4-14,20H,3,15-17H2,1-2H3,(H,29,30)
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 2.13E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348145
PNG
(CHEMBL1800734)
Show SMILES C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3/t10-/m1/s1
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 2.51E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348154
PNG
(CHEMBL1800783)
Show SMILES CC[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3/t10-/m1/s1
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 2.53E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348157
PNG
(CHEMBL1800786)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)/t12-/m1/s1
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 2.55E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348167
PNG
(CHEMBL1800791)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OCc2ccccc2)nn1C |c:4|
Show InChI InChI=1S/C26H25N7O2/c1-17-14-32-24(27-17)22-25(33(26(32)34)15-18-9-5-3-6-10-18)29-23(28-22)20-13-21(30-31(20)2)35-16-19-11-7-4-8-12-19/h3-13,17H,14-16H2,1-2H3,(H,28,29)
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 2.56E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348163
PNG
(CHEMBL1800862)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)no1
Show InChI InChI=1S/C16H18N6O3/c1-4-6-21-15-12(14-17-9(5-2)8-22(14)16(21)23)18-13(19-15)10-7-11(24-3)20-25-10/h4,7,9,17H,1,5-6,8H2,2-3H3
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 3.02E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348172
PNG
(CHEMBL1800796)
Show SMILES C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1 |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3/t9-/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348151
PNG
(CHEMBL1800740)
Show SMILES CC[C@H]1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |r,c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)/t15-/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348161
PNG
(CHEMBL1800798)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(Cc1ccccc1)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)26(3)25-16)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15,22H,4,11-12H2,1-3H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348164
PNG
(CHEMBL1800863)
Show SMILES COc1cc(on1)-c1nc2N(Cc3ccccc3)C(=O)N3CC(C)N=C3c2[nH]1 |c:26|
Show InChI InChI=1S/C19H18N6O3/c1-11-9-24-17(20-11)15-18(22-16(21-15)13-8-14(27-2)23-28-13)25(19(24)26)10-12-6-4-3-5-7-12/h3-8,11H,9-10H2,1-2H3,(H,21,22)
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348152
PNG
(CHEMBL1800781)
Show SMILES COc1cc(-c2nc3c4NC(C)Cn4c(=O)n(CC=C)c3n2)n(C)n1
Show InChI InChI=1S/C16H19N7O2/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)10-7-11(25-4)20-21(10)3/h5,7,9,17H,1,6,8H2,2-4H3
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348164
PNG
(CHEMBL1800863)
Show SMILES COc1cc(on1)-c1nc2N(Cc3ccccc3)C(=O)N3CC(C)N=C3c2[nH]1 |c:26|
Show InChI InChI=1S/C19H18N6O3/c1-11-9-24-17(20-11)15-18(22-16(21-15)13-8-14(27-2)23-28-13)25(19(24)26)10-12-6-4-3-5-7-12/h3-8,11H,9-10H2,1-2H3,(H,21,22)
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348148
PNG
(CHEMBL1800737)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |c:4|
Show InChI InChI=1S/C20H21N7O/c1-12-9-15(25(3)24-12)17-22-16-18-21-13(2)10-26(18)20(28)27(19(16)23-17)11-14-7-5-4-6-8-14/h4-9,13H,10-11H2,1-3H3,(H,22,23)
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348150
PNG
(CHEMBL1800739)
Show SMILES CC[C@@H]1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |r,c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)/t15-/m1/s1
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348152
PNG
(CHEMBL1800781)
Show SMILES COc1cc(-c2nc3c4NC(C)Cn4c(=O)n(CC=C)c3n2)n(C)n1
Show InChI InChI=1S/C16H19N7O2/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)10-7-11(25-4)20-21(10)3/h5,7,9,17H,1,6,8H2,2-4H3
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348154
PNG
(CHEMBL1800783)
Show SMILES CC[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3/t10-/m1/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348157
PNG
(CHEMBL1800786)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)/t12-/m1/s1
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348158
PNG
(CHEMBL1800787)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)/t12-/m0/s1
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348161
PNG
(CHEMBL1800798)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(Cc1ccccc1)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)26(3)25-16)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15,22H,4,11-12H2,1-3H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348144
PNG
(CHEMBL1800733)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348145
PNG
(CHEMBL1800734)
Show SMILES C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3/t10-/m1/s1
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348159
PNG
(CHEMBL1800788)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)nn1C |c:5|
Show InChI InChI=1S/C21H23N7O2/c1-4-14-12-28-19(22-14)17-20(27(21(28)29)11-13-8-6-5-7-9-13)24-18(23-17)15-10-16(30-3)25-26(15)2/h5-10,14H,4,11-12H2,1-3H3,(H,23,24)
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348171
PNG
(CHEMBL1800795)
Show SMILES C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1 |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3/t9-/m1/s1
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348170
PNG
(CHEMBL1800794)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C17H21N7O/c1-5-7-23-16-13(15-18-11(6-2)9-24(15)17(23)25)19-14(20-16)12-8-10(3)22(4)21-12/h5,8,11,18H,1,6-7,9H2,2-4H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348165
PNG
(CHEMBL1800864)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)no1 |c:5|
Show InChI InChI=1S/C20H20N6O3/c1-3-13-11-26-18(21-13)16-19(23-17(22-16)14-9-15(28-2)24-29-14)25(20(26)27)10-12-7-5-4-6-8-12/h4-9,13H,3,10-11H2,1-2H3,(H,22,23)
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348148
PNG
(CHEMBL1800737)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |c:4|
Show InChI InChI=1S/C20H21N7O/c1-12-9-15(25(3)24-12)17-22-16-18-21-13(2)10-26(18)20(28)27(19(16)23-17)11-14-7-5-4-6-8-14/h4-9,13H,10-11H2,1-3H3,(H,22,23)
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348146
PNG
(CHEMBL1800735)
Show SMILES C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3/t10-/m0/s1
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348160
PNG
(CHEMBL1800789)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(CC=C)C2=O)-c1cc(OCc2ccccc2)nn1C |c:4|
Show InChI InChI=1S/C22H23N7O2/c1-4-10-28-21-18(20-23-14(2)12-29(20)22(28)30)24-19(25-21)16-11-17(26-27(16)3)31-13-15-8-6-5-7-9-15/h4-9,11,14H,1,10,12-13H2,2-3H3,(H,24,25)
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348169
PNG
(CHEMBL1800793)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348162
PNG
(CHEMBL1800861)
Show SMILES COc1cc(on1)-c1nc2c3NC(C)Cn3c(=O)n(CC=C)c2n1
Show InChI InChI=1S/C15H16N6O3/c1-4-5-20-14-11(13-16-8(2)7-21(13)15(20)22)17-12(18-14)9-6-10(23-3)19-24-9/h4,6,8,16H,1,5,7H2,2-3H3
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348170
PNG
(CHEMBL1800794)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C17H21N7O/c1-5-7-23-16-13(15-18-11(6-2)9-24(15)17(23)25)19-14(20-16)12-8-10(3)22(4)21-12/h5,8,11,18H,1,6-7,9H2,2-4H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348147
PNG
(CHEMBL1800736)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
Show InChI InChI=1S/C17H21N7O/c1-5-7-23-16-13(15-18-11(6-2)9-24(15)17(23)25)19-14(20-16)12-8-10(3)21-22(12)4/h5,8,11,18H,1,6-7,9H2,2-4H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348149
PNG
(CHEMBL1800738)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348153
PNG
(CHEMBL1800782)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348155
PNG
(CHEMBL1800784)
Show SMILES CC[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3/t10-/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348156
PNG
(CHEMBL1800785)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4CC(C)N=C4c3[nH]2)n(C)n1 |c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348166
PNG
(CHEMBL1800790)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(CC=C)C2=O)-c1cc(OCc2ccccc2)nn1C |c:5|
Show InChI InChI=1S/C23H25N7O2/c1-4-11-29-22-19(21-24-16(5-2)13-30(21)23(29)31)25-20(26-22)17-12-18(27-28(17)3)32-14-15-9-7-6-8-10-15/h4,6-10,12,16H,1,5,11,13-14H2,2-3H3,(H,25,26)
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348172
PNG
(CHEMBL1800796)
Show SMILES C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1 |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3/t9-/m0/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348160
PNG
(CHEMBL1800789)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(CC=C)C2=O)-c1cc(OCc2ccccc2)nn1C |c:4|
Show InChI InChI=1S/C22H23N7O2/c1-4-10-28-21-18(20-23-14(2)12-29(20)22(28)30)24-19(25-21)16-11-17(26-27(16)3)31-13-15-8-6-5-7-9-15/h4-9,11,14H,1,10,12-13H2,2-3H3,(H,24,25)
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348169
PNG
(CHEMBL1800793)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348171
PNG
(CHEMBL1800795)
Show SMILES C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1 |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3/t9-/m1/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348173
PNG
(CHEMBL1800797)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(Cc1ccccc1)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C20H21N7O/c1-12-10-26-18(21-12)16-19(23-17(22-16)15-9-13(2)25(3)24-15)27(20(26)28)11-14-7-5-4-6-8-14/h4-9,12,21H,10-11H2,1-3H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50348162
PNG
(CHEMBL1800861)
Show SMILES COc1cc(on1)-c1nc2c3NC(C)Cn3c(=O)n(CC=C)c2n1
Show InChI InChI=1S/C15H16N6O3/c1-4-5-20-14-11(13-16-8(2)7-21(13)15(20)22)17-12(18-14)9-6-10(23-3)19-24-9/h4,6,8,16H,1,5,7H2,2-3H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells after 120 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50348173
PNG
(CHEMBL1800797)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(Cc1ccccc1)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C20H21N7O/c1-12-10-26-18(21-12)16-19(23-17(22-16)15-9-13(2)25(3)24-15)27(20(26)28)11-14-7-5-4-6-8-14/h4-9,12,21H,10-11H2,1-3H3
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>5.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM 241385 from human adenosine A2A receptor expressed in CHO cells after 60 mins by scintillation spectrometry

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348176
PNG
(CHEMBL1562432)
Show SMILES CC[C@@H]1Cn2c(N1)c1nc(nc1n(C)c2=O)-c1cc(Cl)cc(Cl)c1Cl
Show InChI InChI=1S/C16H14Cl3N5O/c1-3-8-6-24-15(20-8)12-14(23(2)16(24)25)22-13(21-12)9-4-7(17)5-10(18)11(9)19/h4-5,8,20H,3,6H2,1-2H3/t8-/m1/s1
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n/an/a 4n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inverse agonist activity at human recombinant A3 adenosine receptor expressed CHO cells by [35S]GTPgammaS binding assay

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348155
PNG
(CHEMBL1800784)
Show SMILES CC[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3/t10-/m0/s1
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n/an/a 10.5n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348153
PNG
(CHEMBL1800782)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3
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n/an/a 12.2n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348152
PNG
(CHEMBL1800781)
Show SMILES COc1cc(-c2nc3c4NC(C)Cn4c(=O)n(CC=C)c3n2)n(C)n1
Show InChI InChI=1S/C16H19N7O2/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)10-7-11(25-4)20-21(10)3/h5,7,9,17H,1,6,8H2,2-4H3
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n/an/a 14.5n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348163
PNG
(CHEMBL1800862)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)no1
Show InChI InChI=1S/C16H18N6O3/c1-4-6-21-15-12(14-17-9(5-2)8-22(14)16(21)23)18-13(19-15)10-7-11(24-3)20-25-10/h4,7,9,17H,1,5-6,8H2,2-3H3
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n/an/a 14.6n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348157
PNG
(CHEMBL1800786)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)/t12-/m1/s1
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n/an/a 15.9n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348158
PNG
(CHEMBL1800787)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)/t12-/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348159
PNG
(CHEMBL1800788)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)nn1C |c:5|
Show InChI InChI=1S/C21H23N7O2/c1-4-14-12-28-19(22-14)17-20(27(21(28)29)11-13-8-6-5-7-9-13)24-18(23-17)15-10-16(30-3)25-26(15)2/h5-10,14H,4,11-12H2,1-3H3,(H,23,24)
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n/an/a 20.4n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348164
PNG
(CHEMBL1800863)
Show SMILES COc1cc(on1)-c1nc2N(Cc3ccccc3)C(=O)N3CC(C)N=C3c2[nH]1 |c:26|
Show InChI InChI=1S/C19H18N6O3/c1-11-9-24-17(20-11)15-18(22-16(21-15)13-8-14(27-2)23-28-13)25(19(24)26)10-12-6-4-3-5-7-12/h3-8,11H,9-10H2,1-2H3,(H,21,22)
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n/an/a 20.4n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348154
PNG
(CHEMBL1800783)
Show SMILES CC[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3/t10-/m1/s1
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n/an/a 23.4n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348162
PNG
(CHEMBL1800861)
Show SMILES COc1cc(on1)-c1nc2c3NC(C)Cn3c(=O)n(CC=C)c2n1
Show InChI InChI=1S/C15H16N6O3/c1-4-5-20-14-11(13-16-8(2)7-21(13)15(20)22)17-12(18-14)9-6-10(23-3)19-24-9/h4,6,8,16H,1,5,7H2,2-3H3
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n/an/a 24.2n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348165
PNG
(CHEMBL1800864)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)no1 |c:5|
Show InChI InChI=1S/C20H20N6O3/c1-3-13-11-26-18(21-13)16-19(23-17(22-16)14-9-15(28-2)24-29-14)25(20(26)27)10-12-7-5-4-6-8-12/h4-9,13H,3,10-11H2,1-2H3,(H,22,23)
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n/an/a 25.3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348156
PNG
(CHEMBL1800785)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4CC(C)N=C4c3[nH]2)n(C)n1 |c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)
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n/an/a 27.6n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348147
PNG
(CHEMBL1800736)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
Show InChI InChI=1S/C17H21N7O/c1-5-7-23-16-13(15-18-11(6-2)9-24(15)17(23)25)19-14(20-16)12-8-10(3)21-22(12)4/h5,8,11,18H,1,6-7,9H2,2-4H3
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n/an/a 30.3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348144
PNG
(CHEMBL1800733)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3
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n/an/a 34.2n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348145
PNG
(CHEMBL1800734)
Show SMILES C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3/t10-/m1/s1
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n/an/a 35.9n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348146
PNG
(CHEMBL1800735)
Show SMILES C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3/t10-/m0/s1
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n/an/a 40.9n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A3 receptor expressed in CHO cells assessed as blockade of Cl-IB-MECA-mediated inhibition of forskolin-stimulated...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348149
PNG
(CHEMBL1800738)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348154
PNG
(CHEMBL1800783)
Show SMILES CC[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3/t10-/m1/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348156
PNG
(CHEMBL1800785)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4CC(C)N=C4c3[nH]2)n(C)n1 |c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348155
PNG
(CHEMBL1800784)
Show SMILES CC[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C |r|
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3/t10-/m0/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348158
PNG
(CHEMBL1800787)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)/t12-/m0/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348160
PNG
(CHEMBL1800789)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(CC=C)C2=O)-c1cc(OCc2ccccc2)nn1C |c:4|
Show InChI InChI=1S/C22H23N7O2/c1-4-10-28-21-18(20-23-14(2)12-29(20)22(28)30)24-19(25-21)16-11-17(26-27(16)3)31-13-15-8-6-5-7-9-15/h4-9,11,14H,1,10,12-13H2,2-3H3,(H,24,25)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348162
PNG
(CHEMBL1800861)
Show SMILES COc1cc(on1)-c1nc2c3NC(C)Cn3c(=O)n(CC=C)c2n1
Show InChI InChI=1S/C15H16N6O3/c1-4-5-20-14-11(13-16-8(2)7-21(13)15(20)22)17-12(18-14)9-6-10(23-3)19-24-9/h4,6,8,16H,1,5,7H2,2-3H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348163
PNG
(CHEMBL1800862)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)no1
Show InChI InChI=1S/C16H18N6O3/c1-4-6-21-15-12(14-17-9(5-2)8-22(14)16(21)23)18-13(19-15)10-7-11(24-3)20-25-10/h4,7,9,17H,1,5-6,8H2,2-3H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348173
PNG
(CHEMBL1800797)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(Cc1ccccc1)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C20H21N7O/c1-12-10-26-18(21-12)16-19(23-17(22-16)15-9-13(2)25(3)24-15)27(20(26)28)11-14-7-5-4-6-8-14/h4-9,12,21H,10-11H2,1-3H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348150
PNG
(CHEMBL1800739)
Show SMILES CC[C@@H]1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |r,c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)/t15-/m1/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348170
PNG
(CHEMBL1800794)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C17H21N7O/c1-5-7-23-16-13(15-18-11(6-2)9-24(15)17(23)25)19-14(20-16)12-8-10(3)22(4)21-12/h5,8,11,18H,1,6-7,9H2,2-4H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348169
PNG
(CHEMBL1800793)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348165
PNG
(CHEMBL1800864)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)no1 |c:5|
Show InChI InChI=1S/C20H20N6O3/c1-3-13-11-26-18(21-13)16-19(23-17(22-16)14-9-15(28-2)24-29-14)25(20(26)27)10-12-7-5-4-6-8-12/h4-9,13H,3,10-11H2,1-2H3,(H,22,23)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348164
PNG
(CHEMBL1800863)
Show SMILES COc1cc(on1)-c1nc2N(Cc3ccccc3)C(=O)N3CC(C)N=C3c2[nH]1 |c:26|
Show InChI InChI=1S/C19H18N6O3/c1-11-9-24-17(20-11)15-18(22-16(21-15)13-8-14(27-2)23-28-13)25(19(24)26)10-12-6-4-3-5-7-12/h3-8,11H,9-10H2,1-2H3,(H,21,22)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348157
PNG
(CHEMBL1800786)
Show SMILES COc1cc(-c2nc3N(Cc4ccccc4)C(=O)N4C[C@@H](C)N=C4c3[nH]2)n(C)n1 |r,c:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-10-26-18(21-12)16-19(27(20(26)28)11-13-7-5-4-6-8-13)23-17(22-16)14-9-15(29-3)24-25(14)2/h4-9,12H,10-11H2,1-3H3,(H,22,23)/t12-/m1/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348153
PNG
(CHEMBL1800782)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(OC)nn1C
Show InChI InChI=1S/C17H21N7O2/c1-5-7-23-16-13(15-18-10(6-2)9-24(15)17(23)25)19-14(20-16)11-8-12(26-4)21-22(11)3/h5,8,10,18H,1,6-7,9H2,2-4H3
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348152
PNG
(CHEMBL1800781)
Show SMILES COc1cc(-c2nc3c4NC(C)Cn4c(=O)n(CC=C)c3n2)n(C)n1
Show InChI InChI=1S/C16H19N7O2/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)10-7-11(25-4)20-21(10)3/h5,7,9,17H,1,6,8H2,2-4H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348145
PNG
(CHEMBL1800734)
Show SMILES C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3/t10-/m1/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348166
PNG
(CHEMBL1800790)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(CC=C)C2=O)-c1cc(OCc2ccccc2)nn1C |c:5|
Show InChI InChI=1S/C23H25N7O2/c1-4-11-29-22-19(21-24-16(5-2)13-30(21)23(29)31)25-20(26-22)17-12-18(27-28(17)3)32-14-15-9-7-6-8-10-15/h4,6-10,12,16H,1,5,11,13-14H2,2-3H3,(H,25,26)
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Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348161
PNG
(CHEMBL1800798)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(Cc1ccccc1)c2=O)-c1cc(C)n(C)n1
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)26(3)25-16)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15,22H,4,11-12H2,1-3H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348147
PNG
(CHEMBL1800736)
Show SMILES CCC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
Show InChI InChI=1S/C17H21N7O/c1-5-7-23-16-13(15-18-11(6-2)9-24(15)17(23)25)19-14(20-16)12-8-10(3)21-22(12)4/h5,8,11,18H,1,6-7,9H2,2-4H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348146
PNG
(CHEMBL1800735)
Show SMILES C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3/t10-/m0/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348144
PNG
(CHEMBL1800733)
Show SMILES CC1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)nn1C
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-10(3)8-23(14)16(22)24)18-13(19-15)11-7-9(2)20-21(11)4/h5,7,10,17H,1,6,8H2,2-4H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348172
PNG
(CHEMBL1800796)
Show SMILES C[C@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1 |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3/t9-/m0/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348159
PNG
(CHEMBL1800788)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OC)nn1C |c:5|
Show InChI InChI=1S/C21H23N7O2/c1-4-14-12-28-19(22-14)17-20(27(21(28)29)11-13-8-6-5-7-9-13)24-18(23-17)15-10-16(30-3)25-26(15)2/h5-10,14H,4,11-12H2,1-3H3,(H,23,24)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348168
PNG
(CHEMBL1800792)
Show SMILES CCC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OCc2ccccc2)nn1C |c:5|
Show InChI InChI=1S/C27H27N7O2/c1-3-20-16-34-25(28-20)23-26(33(27(34)35)15-18-10-6-4-7-11-18)30-24(29-23)21-14-22(31-32(21)2)36-17-19-12-8-5-9-13-19/h4-14,20H,3,15-17H2,1-2H3,(H,29,30)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348167
PNG
(CHEMBL1800791)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(OCc2ccccc2)nn1C |c:4|
Show InChI InChI=1S/C26H25N7O2/c1-17-14-32-24(27-17)22-25(33(26(32)34)15-18-9-5-3-6-10-18)29-23(28-22)20-13-21(30-31(20)2)35-16-19-11-7-4-8-12-19/h3-13,17H,14-16H2,1-2H3,(H,28,29)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348171
PNG
(CHEMBL1800795)
Show SMILES C[C@@H]1Cn2c(N1)c1nc(nc1n(CC=C)c2=O)-c1cc(C)n(C)n1 |r|
Show InChI InChI=1S/C16H19N7O/c1-5-6-22-15-12(14-17-9(2)8-23(14)16(22)24)18-13(19-15)11-7-10(3)21(4)20-11/h5,7,9,17H,1,6,8H2,2-4H3/t9-/m1/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348148
PNG
(CHEMBL1800737)
Show SMILES CC1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |c:4|
Show InChI InChI=1S/C20H21N7O/c1-12-9-15(25(3)24-12)17-22-16-18-21-13(2)10-26(18)20(28)27(19(16)23-17)11-14-7-5-4-6-8-14/h4-9,13H,10-11H2,1-3H3,(H,22,23)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50348151
PNG
(CHEMBL1800740)
Show SMILES CC[C@H]1CN2C(=N1)c1[nH]c(nc1N(Cc1ccccc1)C2=O)-c1cc(C)nn1C |r,c:5|
Show InChI InChI=1S/C21H23N7O/c1-4-15-12-28-19(22-15)17-20(24-18(23-17)16-10-13(2)25-26(16)3)27(21(28)29)11-14-8-6-5-7-9-14/h5-10,15H,4,11-12H2,1-3H3,(H,23,24)/t15-/m0/s1
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n/an/a>5.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Antagonist activity human adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation after 150 mins ...

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50348175
PNG
(CHEMBL1800865)
Show SMILES CC[C@@H]1Cn2c(N1)c1nc(nc1n(C)c2=O)-c1ccccc1 |r|
Show InChI InChI=1S/C16H17N5O/c1-3-11-9-21-15(17-11)12-14(20(2)16(21)22)19-13(18-12)10-7-5-4-6-8-10/h4-8,11,17H,3,9H2,1-2H3/t11-/m1/s1
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n/an/an/a 4.90n/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant A3 adenosine receptor expressed in CHO cells

J Med Chem 54: 5205-20 (2011)


Article DOI: 10.1021/jm2004738
BindingDB Entry DOI: 10.7270/Q21N81G6
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%