BindingDB logo
myBDB logout

PubMed code 7731018

Compile data set for download or QSAR
Found 64 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 A2a


(Rattus norvegicus (rat))
BDBM50034383
PNG
(1-(3-Amino-phenyl)-3-methyl-1H-chromeno[2,3-c]pyra...)
Show SMILES Cc1nn(-c2cccc(N)c2)c2oc3ccccc3c(=O)c12
Show InChI InChI=1S/C17H13N3O2/c1-10-15-16(21)13-7-2-3-8-14(13)22-17(15)20(19-10)12-6-4-5-11(18)9-12/h2-9H,18H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
25n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034379
PNG
(1-(3-Amino-phenyl)-6-methoxy-3-methyl-1H-chromeno[...)
Show SMILES COc1ccc2oc3n(nc(C)c3c(=O)c2c1)-c1cccc(N)c1
Show InChI InChI=1S/C18H15N3O3/c1-10-16-17(22)14-9-13(23-2)6-7-15(14)24-18(16)21(20-10)12-5-3-4-11(19)8-12/h3-9H,19H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
90n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034376
PNG
(1-(3-Amino-phenyl)-3-methyl-7-propoxy-1H-chromeno[...)
Show SMILES CCCOc1ccc2c(c1)oc1n(nc(C)c1c2=O)-c1cccc(N)c1
Show InChI InChI=1S/C20H19N3O3/c1-3-9-25-15-7-8-16-17(11-15)26-20-18(19(16)24)12(2)22-23(20)14-6-4-5-13(21)10-14/h4-8,10-11H,3,9,21H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
200n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034399
PNG
(7-Hydroxy-3-methyl-1-phenyl-1H-chromeno[2,3-c]pyra...)
Show SMILES Cc1nn(-c2ccccc2)c2oc3cc(O)ccc3c(=O)c12
Show InChI InChI=1S/C17H12N2O3/c1-10-15-16(21)13-8-7-12(20)9-14(13)22-17(15)19(18-10)11-5-3-2-4-6-11/h2-9,20H,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
220n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034388
PNG
(1-(3-Nitro-phenyl)-1H-imidazo[4,5-b]quinoxaline | ...)
Show SMILES [O-][N+](=O)c1cccc(c1)-n1cnc2nc3ccccc3nc12
Show InChI InChI=1S/C15H9N5O2/c21-20(22)11-5-3-4-10(8-11)19-9-16-14-15(19)18-13-7-2-1-6-12(13)17-14/h1-9H
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
240n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034372
PNG
(1-(3-Methoxy-phenyl)-3-methyl-1,9-dihydro-pyrazolo...)
Show SMILES COc1cccc(c1)-n1nc(C)c2c(O)c3ccccc3nc12
Show InChI InChI=1S/C18H15N3O2/c1-11-16-17(22)14-8-3-4-9-15(14)19-18(16)21(20-11)12-6-5-7-13(10-12)23-2/h3-10H,1-2H3,(H,19,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
250n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034384
PNG
(1-(3-Amino-phenyl)-7-methoxy-3-methyl-1H-chromeno[...)
Show SMILES COc1ccc2c(c1)oc1n(nc(C)c1c2=O)-c1cccc(N)c1
Show InChI InChI=1S/C18H15N3O3/c1-10-16-17(22)14-7-6-13(23-2)9-15(14)24-18(16)21(20-10)12-5-3-4-11(19)8-12/h3-9H,19H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
260n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034396
PNG
(6-Methoxy-3-methyl-1-phenyl-1H-chromeno[2,3-c]pyra...)
Show SMILES COc1ccc2oc3n(nc(C)c3c(=O)c2c1)-c1ccccc1
Show InChI InChI=1S/C18H14N2O3/c1-11-16-17(21)14-10-13(22-2)8-9-15(14)23-18(16)20(19-11)12-6-4-3-5-7-12/h3-10H,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
270n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034378
PNG
(7-Methoxy-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[...)
Show SMILES COc1ccc2c(c1)oc1n(nc(C)c1c2=O)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C18H13N3O5/c1-10-16-17(22)14-7-6-13(25-2)9-15(14)26-18(16)20(19-10)11-4-3-5-12(8-11)21(23)24/h3-9H,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
310n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034389
PNG
(6-Hydroxy-3-methyl-1-phenyl-1H-chromeno[2,3-c]pyra...)
Show SMILES Cc1nn(-c2ccccc2)c2oc3ccc(O)cc3c(=O)c12
Show InChI InChI=1S/C17H12N2O3/c1-10-15-16(21)13-9-12(20)7-8-14(13)22-17(15)19(18-10)11-5-3-2-4-6-11/h2-9,20H,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
340n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034390
PNG
(7-Hydroxy-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3cc(=[OH+])ccc3c([O-])c12
Show InChI InChI=1S/C17H11N3O5/c1-9-15-16(22)13-6-5-12(21)8-14(13)25-17(15)19(18-9)10-3-2-4-11(7-10)20(23)24/h2-8,22H,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
360n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034393
PNG
(6-Hydroxy-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3ccc(O)cc3c(=O)c12
Show InChI InChI=1S/C17H11N3O5/c1-9-15-16(22)13-8-12(21)5-6-14(13)25-17(15)19(18-9)10-3-2-4-11(7-10)20(23)24/h2-8,21H,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
380n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034375
PNG
(7-Methoxy-3-methyl-1-phenyl-1H-chromeno[2,3-c]pyra...)
Show SMILES COc1ccc2c(c1)oc1n(nc(C)c1c2=O)-c1ccccc1
Show InChI InChI=1S/C18H14N2O3/c1-11-16-17(21)14-9-8-13(22-2)10-15(14)23-18(16)20(19-11)12-6-4-3-5-7-12/h3-10H,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
460n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034382
PNG
(3-Methyl-1-(3-nitro-phenyl)-1,9-dihydro-pyrazolo[3...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H12N4O3/c1-10-15-16(22)13-7-2-3-8-14(13)18-17(15)20(19-10)11-5-4-6-12(9-11)21(23)24/h2-9H,1H3,(H,18,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
470n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034381
PNG
(6-Bromo-3-methyl-1-phenyl-1H-chromeno[2,3-c]pyrazo...)
Show SMILES Cc1nn(-c2ccccc2)c2oc3ccc(Br)cc3c(=O)c12
Show InChI InChI=1S/C17H11BrN2O2/c1-10-15-16(21)13-9-11(18)7-8-14(13)22-17(15)20(19-10)12-5-3-2-4-6-12/h2-9H,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
530n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034391
PNG
(1-(3-Amino-phenyl)-7-hydroxy-3-methyl-1H-chromeno[...)
Show SMILES Cc1nn(-c2cccc(N)c2)c2oc3cc(O)ccc3c(=O)c12
Show InChI InChI=1S/C17H13N3O3/c1-9-15-16(22)13-6-5-12(21)8-14(13)23-17(15)20(19-9)11-4-2-3-10(18)7-11/h2-8,21H,18H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
640n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034372
PNG
(1-(3-Methoxy-phenyl)-3-methyl-1,9-dihydro-pyrazolo...)
Show SMILES COc1cccc(c1)-n1nc(C)c2c(O)c3ccccc3nc12
Show InChI InChI=1S/C18H15N3O2/c1-11-16-17(22)14-8-3-4-9-15(14)19-18(16)21(20-11)12-6-5-7-13(10-12)23-2/h3-10H,1-2H3,(H,19,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
710n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034373
PNG
(1-(3-Amino-phenyl)-6-bromo-3-methyl-1H-chromeno[2,...)
Show SMILES Cc1nn(-c2cccc(N)c2)c2oc3ccc(Br)cc3c(=O)c12
Show InChI InChI=1S/C17H12BrN3O2/c1-9-15-16(22)13-7-10(18)5-6-14(13)23-17(15)21(20-9)12-4-2-3-11(19)8-12/h2-8H,19H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
780n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034391
PNG
(1-(3-Amino-phenyl)-7-hydroxy-3-methyl-1H-chromeno[...)
Show SMILES Cc1nn(-c2cccc(N)c2)c2oc3cc(O)ccc3c(=O)c12
Show InChI InChI=1S/C17H13N3O3/c1-9-15-16(22)13-6-5-12(21)8-14(13)23-17(15)20(19-9)11-4-2-3-10(18)7-11/h2-8,21H,18H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
920n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034377
PNG
(1-(3-Amino-4-chloro-phenyl)-3-methyl-1H-chromeno[2...)
Show SMILES Cc1nn(-c2ccc(Cl)c(N)c2)c2oc3ccccc3c(=O)c12
Show InChI InChI=1S/C17H12ClN3O2/c1-9-15-16(22)11-4-2-3-5-14(11)23-17(15)21(20-9)10-6-7-12(18)13(19)8-10/h2-8H,19H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
940n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034389
PNG
(6-Hydroxy-3-methyl-1-phenyl-1H-chromeno[2,3-c]pyra...)
Show SMILES Cc1nn(-c2ccccc2)c2oc3ccc(O)cc3c(=O)c12
Show InChI InChI=1S/C17H12N2O3/c1-10-15-16(21)13-9-12(20)7-8-14(13)22-17(15)19(18-10)11-5-3-2-4-6-11/h2-9,20H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.18E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034384
PNG
(1-(3-Amino-phenyl)-7-methoxy-3-methyl-1H-chromeno[...)
Show SMILES COc1ccc2c(c1)oc1n(nc(C)c1c2=O)-c1cccc(N)c1
Show InChI InChI=1S/C18H15N3O3/c1-10-16-17(22)14-7-6-13(23-2)9-15(14)24-18(16)21(20-10)12-5-3-4-11(19)8-12/h3-9H,19H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.22E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034379
PNG
(1-(3-Amino-phenyl)-6-methoxy-3-methyl-1H-chromeno[...)
Show SMILES COc1ccc2oc3n(nc(C)c3c(=O)c2c1)-c1cccc(N)c1
Show InChI InChI=1S/C18H15N3O3/c1-10-16-17(22)14-9-13(23-2)6-7-15(14)24-18(16)21(20-10)12-5-3-4-11(19)8-12/h3-9H,19H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.37E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034404
PNG
(1-(3-Hydroxy-phenyl)-3-methyl-1,9-dihydro-pyrazolo...)
Show SMILES Cc1nn(-c2cccc(O)c2)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H13N3O2/c1-10-15-16(22)13-7-2-3-8-14(13)18-17(15)20(19-10)11-5-4-6-12(21)9-11/h2-9,21H,1H3,(H,18,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.50E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034396
PNG
(6-Methoxy-3-methyl-1-phenyl-1H-chromeno[2,3-c]pyra...)
Show SMILES COc1ccc2oc3n(nc(C)c3c(=O)c2c1)-c1ccccc1
Show InChI InChI=1S/C18H14N2O3/c1-11-16-17(21)14-10-13(22-2)8-9-15(14)23-18(16)20(19-11)12-6-4-3-5-7-12/h3-10H,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.62E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034402
PNG
(1-(3-Benzylamino-phenyl)-3-methyl-1H-chromeno[2,3-...)
Show SMILES Cc1nn(-c2cccc(NCc3ccccc3)c2)c2oc3ccccc3c(=O)c12
Show InChI InChI=1S/C24H19N3O2/c1-16-22-23(28)20-12-5-6-13-21(20)29-24(22)27(26-16)19-11-7-10-18(14-19)25-15-17-8-3-2-4-9-17/h2-14,25H,15H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.93E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034404
PNG
(1-(3-Hydroxy-phenyl)-3-methyl-1,9-dihydro-pyrazolo...)
Show SMILES Cc1nn(-c2cccc(O)c2)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H13N3O2/c1-10-15-16(22)13-7-2-3-8-14(13)18-17(15)20(19-10)11-5-4-6-12(21)9-11/h2-9,21H,1H3,(H,18,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.23E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034385
PNG
(3-Imidazo[4,5-b]quinoxalin-1-yl-phenol | CHEMBL285...)
Show SMILES Oc1cccc(c1)-n1cnc2nc3ccccc3nc12
Show InChI InChI=1S/C15H10N4O/c20-11-5-3-4-10(8-11)19-9-16-14-15(19)18-13-7-2-1-6-12(13)17-14/h1-9,20H
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.63E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034373
PNG
(1-(3-Amino-phenyl)-6-bromo-3-methyl-1H-chromeno[2,...)
Show SMILES Cc1nn(-c2cccc(N)c2)c2oc3ccc(Br)cc3c(=O)c12
Show InChI InChI=1S/C17H12BrN3O2/c1-9-15-16(22)13-7-10(18)5-6-14(13)23-17(15)21(20-9)12-4-2-3-11(19)8-12/h2-8H,19H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.70E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034381
PNG
(6-Bromo-3-methyl-1-phenyl-1H-chromeno[2,3-c]pyrazo...)
Show SMILES Cc1nn(-c2ccccc2)c2oc3ccc(Br)cc3c(=O)c12
Show InChI InChI=1S/C17H11BrN2O2/c1-10-15-16(21)13-9-11(18)7-8-14(13)22-17(15)20(19-10)12-5-3-2-4-6-12/h2-9H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.92E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034388
PNG
(1-(3-Nitro-phenyl)-1H-imidazo[4,5-b]quinoxaline | ...)
Show SMILES [O-][N+](=O)c1cccc(c1)-n1cnc2nc3ccccc3nc12
Show InChI InChI=1S/C15H9N5O2/c21-20(22)11-5-3-4-10(8-11)19-9-16-14-15(19)18-13-7-2-1-6-12(13)17-14/h1-9H
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
2.96E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034383
PNG
(1-(3-Amino-phenyl)-3-methyl-1H-chromeno[2,3-c]pyra...)
Show SMILES Cc1nn(-c2cccc(N)c2)c2oc3ccccc3c(=O)c12
Show InChI InChI=1S/C17H13N3O2/c1-10-15-16(21)13-7-2-3-8-14(13)22-17(15)20(19-10)12-6-4-5-11(18)9-12/h2-9H,18H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
3.20E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034402
PNG
(1-(3-Benzylamino-phenyl)-3-methyl-1H-chromeno[2,3-...)
Show SMILES Cc1nn(-c2cccc(NCc3ccccc3)c2)c2oc3ccccc3c(=O)c12
Show InChI InChI=1S/C24H19N3O2/c1-16-22-23(28)20-12-5-6-13-21(20)29-24(22)27(26-16)19-11-7-10-18(14-19)25-15-17-8-3-2-4-9-17/h2-14,25H,15H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
3.28E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034398
PNG
(3-Methyl-1-phenyl-1,9-dihydro-pyrazolo[3,4-b]quino...)
Show SMILES Cc1nn(-c2ccccc2)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H13N3O/c1-11-15-16(21)13-9-5-6-10-14(13)18-17(15)20(19-11)12-7-3-2-4-8-12/h2-10H,1H3,(H,18,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
3.30E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034400
PNG
(6-Bromo-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[2,...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3ccc(Br)cc3c(=O)c12
Show InChI InChI=1S/C17H10BrN3O4/c1-9-15-16(22)13-7-10(18)5-6-14(13)25-17(15)20(19-9)11-3-2-4-12(8-11)21(23)24/h2-8H,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
3.50E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034399
PNG
(7-Hydroxy-3-methyl-1-phenyl-1H-chromeno[2,3-c]pyra...)
Show SMILES Cc1nn(-c2ccccc2)c2oc3cc(O)ccc3c(=O)c12
Show InChI InChI=1S/C17H12N2O3/c1-10-15-16(21)13-8-7-12(20)9-14(13)22-17(15)19(18-10)11-5-3-2-4-6-11/h2-9,20H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
3.69E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034398
PNG
(3-Methyl-1-phenyl-1,9-dihydro-pyrazolo[3,4-b]quino...)
Show SMILES Cc1nn(-c2ccccc2)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H13N3O/c1-11-15-16(21)13-9-5-6-10-14(13)18-17(15)20(19-11)12-7-3-2-4-8-12/h2-10H,1H3,(H,18,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
3.70E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034387
PNG
(1-(3-Amino-4-chloro-phenyl)-3-methyl-1,9-dihydro-p...)
Show SMILES Cc1nn(-c2ccc(Cl)c(N)c2)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H13ClN4O/c1-9-15-16(23)11-4-2-3-5-14(11)20-17(15)22(21-9)10-6-7-12(18)13(19)8-10/h2-8H,19H2,1H3,(H,20,23)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
4.46E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034387
PNG
(1-(3-Amino-4-chloro-phenyl)-3-methyl-1,9-dihydro-p...)
Show SMILES Cc1nn(-c2ccc(Cl)c(N)c2)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H13ClN4O/c1-9-15-16(23)11-4-2-3-5-14(11)20-17(15)22(21-9)10-6-7-12(18)13(19)8-10/h2-8H,19H2,1H3,(H,20,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
4.47E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034374
PNG
(1-(3-Methoxy-phenyl)-1H-imidazo[4,5-b]quinoxaline ...)
Show SMILES COc1cccc(c1)-n1cnc2nc3ccccc3nc12
Show InChI InChI=1S/C16H12N4O/c1-21-12-6-4-5-11(9-12)20-10-17-15-16(20)19-14-8-3-2-7-13(14)18-15/h2-10H,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
5.10E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034380
PNG
(1-(3-Amino-phenyl)-3-methyl-1,9-dihydro-pyrazolo[3...)
Show SMILES Cc1nn(-c2cccc(N)c2)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H14N4O/c1-10-15-16(22)13-7-2-3-8-14(13)19-17(15)21(20-10)12-6-4-5-11(18)9-12/h2-9H,18H2,1H3,(H,19,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
5.16E+3n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034397
PNG
(1-(3-Amino-phenyl)-3-methyl-7-phenethyloxy-1H-chro...)
Show SMILES Cc1nn(-c2cccc(N)c2)c2oc3cc(OCCc4ccccc4)ccc3c(=O)c12
Show InChI InChI=1S/C25H21N3O3/c1-16-23-24(29)21-11-10-20(30-13-12-17-6-3-2-4-7-17)15-22(21)31-25(23)28(27-16)19-9-5-8-18(26)14-19/h2-11,14-15H,12-13,26H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.60E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034380
PNG
(1-(3-Amino-phenyl)-3-methyl-1,9-dihydro-pyrazolo[3...)
Show SMILES Cc1nn(-c2cccc(N)c2)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H14N4O/c1-10-15-16(22)13-7-2-3-8-14(13)19-17(15)21(20-10)12-6-4-5-11(18)9-12/h2-9H,18H2,1H3,(H,19,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.80E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034374
PNG
(1-(3-Methoxy-phenyl)-1H-imidazo[4,5-b]quinoxaline ...)
Show SMILES COc1cccc(c1)-n1cnc2nc3ccccc3nc12
Show InChI InChI=1S/C16H12N4O/c1-21-12-6-4-5-11(9-12)20-10-17-15-16(20)19-14-8-3-2-7-13(14)18-15/h2-10H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.82E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034403
PNG
(1-(4-Chloro-3-nitro-phenyl)-3-methyl-1H-chromeno[2...)
Show SMILES Cc1nn(-c2ccc(Cl)c(c2)[N+]([O-])=O)c2oc3ccccc3c(=O)c12
Show InChI InChI=1S/C17H10ClN3O4/c1-9-15-16(22)11-4-2-3-5-14(11)25-17(15)20(19-9)10-6-7-12(18)13(8-10)21(23)24/h2-8H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034378
PNG
(7-Methoxy-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[...)
Show SMILES COc1ccc2c(c1)oc1n(nc(C)c1c2=O)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C18H13N3O5/c1-10-16-17(22)14-7-6-13(25-2)9-15(14)26-18(16)20(19-10)11-4-3-5-12(8-11)21(23)24/h3-9H,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034392
PNG
(1-(4-Chloro-3-nitro-phenyl)-3-methyl-1,9-dihydro-p...)
Show SMILES Cc1nn(-c2ccc(Cl)c(c2)[N+]([O-])=O)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H11ClN4O3/c1-9-15-16(23)11-4-2-3-5-13(11)19-17(15)21(20-9)10-6-7-12(18)14(8-10)22(24)25/h2-8H,1H3,(H,19,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034397
PNG
(1-(3-Amino-phenyl)-3-methyl-7-phenethyloxy-1H-chro...)
Show SMILES Cc1nn(-c2cccc(N)c2)c2oc3cc(OCCc4ccccc4)ccc3c(=O)c12
Show InChI InChI=1S/C25H21N3O3/c1-16-23-24(29)21-11-10-20(30-13-12-17-6-3-2-4-7-17)15-22(21)31-25(23)28(27-16)19-9-5-8-18(26)14-19/h2-11,14-15H,12-13,26H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034403
PNG
(1-(4-Chloro-3-nitro-phenyl)-3-methyl-1H-chromeno[2...)
Show SMILES Cc1nn(-c2ccc(Cl)c(c2)[N+]([O-])=O)c2oc3ccccc3c(=O)c12
Show InChI InChI=1S/C17H10ClN3O4/c1-9-15-16(22)11-4-2-3-5-14(11)25-17(15)20(19-9)10-6-7-12(18)13(8-10)21(23)24/h2-8H,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034386
PNG
(6-Methoxy-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[...)
Show SMILES COc1ccc2oc3n(nc(C)c3c(=O)c2c1)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C18H13N3O5/c1-10-16-17(22)14-9-13(25-2)6-7-15(14)26-18(16)20(19-10)11-4-3-5-12(8-11)21(23)24/h3-9H,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034395
PNG
(7-Benzyloxy-3-methyl-1-(3-nitro-phenyl)-1H-chromen...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3cc(OCc4ccccc4)ccc3c(=O)c12
Show InChI InChI=1S/C24H17N3O5/c1-15-22-23(28)20-11-10-19(31-14-16-6-3-2-4-7-16)13-21(20)32-24(22)26(25-15)17-8-5-9-18(12-17)27(29)30/h2-13H,14H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034394
PNG
(3-Methyl-1-(3-nitro-phenyl)-7-propoxy-1H-chromeno[...)
Show SMILES CCCOc1ccc2c(c1)oc1n(nc(C)c1c2=O)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C20H17N3O5/c1-3-9-27-15-7-8-16-17(11-15)28-20-18(19(16)24)12(2)21-22(20)13-5-4-6-14(10-13)23(25)26/h4-8,10-11H,3,9H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034385
PNG
(3-Imidazo[4,5-b]quinoxalin-1-yl-phenol | CHEMBL285...)
Show SMILES Oc1cccc(c1)-n1cnc2nc3ccccc3nc12
Show InChI InChI=1S/C15H10N4O/c20-11-5-3-4-10(8-11)19-9-16-14-15(19)18-13-7-2-1-6-12(13)17-14/h1-9,20H
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034400
PNG
(6-Bromo-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[2,...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3ccc(Br)cc3c(=O)c12
Show InChI InChI=1S/C17H10BrN3O4/c1-9-15-16(22)13-7-10(18)5-6-14(13)25-17(15)20(19-9)11-3-2-4-12(8-11)21(23)24/h2-8H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034401
PNG
(3-Methyl-1-(3-nitro-phenyl)-7-phenethyloxy-1H-chro...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3cc(OCCc4ccccc4)ccc3c(=O)c12
Show InChI InChI=1S/C25H19N3O5/c1-16-23-24(29)21-11-10-20(32-13-12-17-6-3-2-4-7-17)15-22(21)33-25(23)27(26-16)18-8-5-9-19(14-18)28(30)31/h2-11,14-15H,12-13H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034390
PNG
(7-Hydroxy-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3cc(=[OH+])ccc3c([O-])c12
Show InChI InChI=1S/C17H11N3O5/c1-9-15-16(22)13-6-5-12(21)8-14(13)25-17(15)19(18-9)10-3-2-4-11(7-10)20(23)24/h2-8,22H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034394
PNG
(3-Methyl-1-(3-nitro-phenyl)-7-propoxy-1H-chromeno[...)
Show SMILES CCCOc1ccc2c(c1)oc1n(nc(C)c1c2=O)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C20H17N3O5/c1-3-9-27-15-7-8-16-17(11-15)28-20-18(19(16)24)12(2)21-22(20)13-5-4-6-14(10-13)23(25)26/h4-8,10-11H,3,9H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034395
PNG
(7-Benzyloxy-3-methyl-1-(3-nitro-phenyl)-1H-chromen...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3cc(OCc4ccccc4)ccc3c(=O)c12
Show InChI InChI=1S/C24H17N3O5/c1-15-22-23(28)20-11-10-19(31-14-16-6-3-2-4-7-16)13-21(20)32-24(22)26(25-15)17-8-5-9-18(12-17)27(29)30/h2-13H,14H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034392
PNG
(1-(4-Chloro-3-nitro-phenyl)-3-methyl-1,9-dihydro-p...)
Show SMILES Cc1nn(-c2ccc(Cl)c(c2)[N+]([O-])=O)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H11ClN4O3/c1-9-15-16(23)11-4-2-3-5-13(11)19-17(15)21(20-9)10-6-7-12(18)14(8-10)22(24)25/h2-8H,1H3,(H,19,23)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034377
PNG
(1-(3-Amino-4-chloro-phenyl)-3-methyl-1H-chromeno[2...)
Show SMILES Cc1nn(-c2ccc(Cl)c(N)c2)c2oc3ccccc3c(=O)c12
Show InChI InChI=1S/C17H12ClN3O2/c1-9-15-16(22)11-4-2-3-5-14(11)23-17(15)21(20-9)10-6-7-12(18)13(19)8-10/h2-8H,19H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50034401
PNG
(3-Methyl-1-(3-nitro-phenyl)-7-phenethyloxy-1H-chro...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2oc3cc(OCCc4ccccc4)ccc3c(=O)c12
Show InChI InChI=1S/C25H19N3O5/c1-16-23-24(29)21-11-10-20(32-13-12-17-6-3-2-4-7-17)15-22(21)33-25(23)27(26-16)18-8-5-9-19(14-18)28(30)31/h2-11,14-15H,12-13H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A1 receptor using [3H]-CHA as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034382
PNG
(3-Methyl-1-(3-nitro-phenyl)-1,9-dihydro-pyrazolo[3...)
Show SMILES Cc1nn(-c2cccc(c2)[N+]([O-])=O)c2nc3ccccc3c(O)c12
Show InChI InChI=1S/C17H12N4O3/c1-10-15-16(22)13-7-2-3-8-14(13)18-17(15)20(19-10)11-5-4-6-12(9-11)21(23)24/h2-9H,1H3,(H,18,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034375
PNG
(7-Methoxy-3-methyl-1-phenyl-1H-chromeno[2,3-c]pyra...)
Show SMILES COc1ccc2c(c1)oc1n(nc(C)c1c2=O)-c1ccccc1
Show InChI InChI=1S/C18H14N2O3/c1-11-16-17(21)14-9-8-13(22-2)10-15(14)23-18(16)20(19-11)12-6-4-3-5-7-12/h3-10H,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Rattus norvegicus (rat))
BDBM50034386
PNG
(6-Methoxy-3-methyl-1-(3-nitro-phenyl)-1H-chromeno[...)
Show SMILES COc1ccc2oc3n(nc(C)c3c(=O)c2c1)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C18H13N3O5/c1-10-16-17(22)14-9-13(25-2)6-7-15(14)26-18(16)20(19-10)11-4-3-5-12(8-11)21(23)24/h3-9H,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>2.00E+4n/an/an/an/an/an/an/an/a



Università di Firenze

Curated by ChEMBL


Assay Description
Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.


J Med Chem 38: 1330-6 (1995)


BindingDB Entry DOI: 10.7270/Q27S7MTK
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%