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Compile Data Set for Download or QSAR

Found 340 hits with Last Name = 'karton' and Initial = 'y'   
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
Muscarinic acetylcholine receptor M1


(RAT)		BDBM82376
PNG
(CAS_80880-90-6 | NSC_5387 | TELENZEPINE)
Show SMILES CN1CCN(CC(=O)N2c3c(C)scc3C(=O)Nc3ccccc23)CC1
Show InChI InChI=1S/C19H22N4O2S/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22/h3-6,12H,7-11H2,1-2H3,(H,20,25)
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 1.80n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-methylscopolamine to muscarinic acetylcholine receptor M1 of transfected rat A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50280621
PNG
(4-{2-[4-(10-Amino-decyl)-piperazin-1-yl]-acetyl}-3...)
Show SMILES Cc1scc2c1N(C(=O)CN1CCN(CCCCCCCCCCN)CC1)c1ccccc1NC2=O
Show InChI InChI=1S/C28H41N5O2S/c1-22-27-23(21-36-22)28(35)30-24-12-8-9-13-25(24)33(27)26(34)20-32-18-16-31(17-19-32)15-11-7-5-3-2-4-6-10-14-29/h8-9,12-13,21H,2-7,10-11,14-20,29H2,1H3,(H,30,35)
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 2.40n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory constant of the compound was determined by the inhibition of [3H]-N-methylscopolamine (NMS) binding to m1 receptor of transfected A9L cell...

Bioorg Med Chem Lett 2: 845-850 (1992)


Article DOI: 10.1016/S0960-894X(00)80542-9
BindingDB Entry DOI: 10.7270/Q2F18ZMP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012344
PNG
(11-{2-[4-(10-Diethylamino-decyl)-piperazin-1-yl]-a...)
Show SMILES CCN(CC)CCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C32H48N6O2/c1-3-35(4-2)20-13-9-7-5-6-8-10-14-21-36-22-24-37(25-23-36)26-30(39)38-29-18-12-11-16-27(29)32(40)34-28-17-15-19-33-31(28)38/h11-12,15-19H,3-10,13-14,20-26H2,1-2H3,(H,34,40)
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 3n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M1 of transfected A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012336
PNG
(11-(2-{4-[10-(2-Methoxy-benzylamino)-decyl]-pipera...)
Show SMILES COc1ccccc1CNCCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C36H48N6O3/c1-45-33-19-11-8-15-29(33)27-37-20-12-6-4-2-3-5-7-13-22-40-23-25-41(26-24-40)28-34(43)42-32-18-10-9-16-30(32)36(44)39-31-17-14-21-38-35(31)42/h8-11,14-19,21,37H,2-7,12-13,20,22-28H2,1H3,(H,39,44)
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 3.30n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M1 of transfected A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50280621
PNG
(4-{2-[4-(10-Amino-decyl)-piperazin-1-yl]-acetyl}-3...)
Show SMILES Cc1scc2c1N(C(=O)CN1CCN(CCCCCCCCCCN)CC1)c1ccccc1NC2=O
Show InChI InChI=1S/C28H41N5O2S/c1-22-27-23(21-36-22)28(35)30-24-12-8-9-13-25(24)33(27)26(34)20-32-18-16-31(17-19-32)15-11-7-5-3-2-4-6-10-14-29/h8-9,12-13,21H,2-7,10-11,14-20,29H2,1H3,(H,30,35)
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 3.70n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory constant of the compound was determined by the inhibition of [3H]-N-methylscopolamine (NMS) binding to Muscarinic acetylcholine receptor M...

Bioorg Med Chem Lett 2: 845-850 (1992)


Article DOI: 10.1016/S0960-894X(00)80542-9
BindingDB Entry DOI: 10.7270/Q2F18ZMP
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)		BDBM82376
PNG
(CAS_80880-90-6 | NSC_5387 | TELENZEPINE)
Show SMILES CN1CCN(CC(=O)N2c3c(C)scc3C(=O)Nc3ccccc23)CC1
Show InChI InChI=1S/C19H22N4O2S/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22/h3-6,12H,7-11H2,1-2H3,(H,20,25)
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 6.90n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-methylscopolamine to muscarinic acetylcholine receptor M3 of transfected rat A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012353
PNG
(11-{2-[4-(10-Amino-decyl)-piperazin-1-yl]-acetyl}-...)
Show SMILES NCCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C28H40N6O2/c29-15-9-5-3-1-2-4-6-10-17-32-18-20-33(21-19-32)22-26(35)34-25-14-8-7-12-23(25)28(36)31-24-13-11-16-30-27(24)34/h7-8,11-14,16H,1-6,9-10,15,17-22,29H2,(H,31,36)
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 12n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M2 of rat heart tissue membranes.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047159
PNG
(1,3-Dimethyl-7-phenethyl-8-[2-(3,4,5-trimethoxy-ph...)
Show SMILES COc1cc(\C=C\c2nc3n(C)c(=O)n(C)c(=O)c3n2CCc2ccccc2)cc(OC)c1OC
Show InChI InChI=1S/C26H28N4O5/c1-28-24-22(25(31)29(2)26(28)32)30(14-13-17-9-7-6-8-10-17)21(27-24)12-11-18-15-19(33-3)23(35-5)20(16-18)34-4/h6-12,15-16H,13-14H2,1-5H3/b12-11+
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 14n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012344
PNG
(11-{2-[4-(10-Diethylamino-decyl)-piperazin-1-yl]-a...)
Show SMILES CCN(CC)CCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C32H48N6O2/c1-3-35(4-2)20-13-9-7-5-6-8-10-14-21-36-22-24-37(25-23-36)26-30(39)38-29-18-12-11-16-27(29)32(40)34-28-17-15-19-33-31(28)38/h11-12,15-19H,3-10,13-14,20-26H2,1-2H3,(H,34,40)
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 14n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M2 of rat heart tissue membranes.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012353
PNG
(11-{2-[4-(10-Amino-decyl)-piperazin-1-yl]-acetyl}-...)
Show SMILES NCCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C28H40N6O2/c29-15-9-5-3-1-2-4-6-10-17-32-18-20-33(21-19-32)22-26(35)34-25-14-8-7-12-23(25)28(36)31-24-13-11-16-30-27(24)34/h7-8,11-14,16H,1-6,9-10,15,17-22,29H2,(H,31,36)
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 16n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M1 of transfected A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(RAT)		BDBM82376
PNG
(CAS_80880-90-6 | NSC_5387 | TELENZEPINE)
Show SMILES CN1CCN(CC(=O)N2c3c(C)scc3C(=O)Nc3ccccc23)CC1
Show InChI InChI=1S/C19H22N4O2S/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22/h3-6,12H,7-11H2,1-2H3,(H,20,25)
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 17n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to muscarinic acetylcholine receptor M4 of rat heart NG108-15 cells

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012348
PNG
(2-(6-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-benzo[e]pyrido...)
Show SMILES O=C(CN1CCN(CCCCCCN2C(=O)c3ccccc3C2=O)CC1)N1c2ccccc2C(=O)Nc2cccnc12
Show InChI InChI=1S/C32H34N6O4/c39-28(38-27-14-6-5-12-25(27)30(40)34-26-13-9-15-33-29(26)38)22-36-20-18-35(19-21-36)16-7-1-2-8-17-37-31(41)23-10-3-4-11-24(23)32(37)42/h3-6,9-15H,1-2,7-8,16-22H2,(H,34,40)
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 18n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M1 of transfected A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012348
PNG
(2-(6-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-benzo[e]pyrido...)
Show SMILES O=C(CN1CCN(CCCCCCN2C(=O)c3ccccc3C2=O)CC1)N1c2ccccc2C(=O)Nc2cccnc12
Show InChI InChI=1S/C32H34N6O4/c39-28(38-27-14-6-5-12-25(27)30(40)34-26-13-9-15-33-29(26)38)22-36-20-18-35(19-21-36)16-7-1-2-8-17-37-31(41)23-10-3-4-11-24(23)32(37)42/h3-6,9-15H,1-2,7-8,16-22H2,(H,34,40)
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 18n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M2 of rat heart tissue membranes.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047206
PNG
(8-[2-(3-Amino-phenyl)-vinyl]-7-methyl-1,3-dipropyl...)
Show SMILES CCCn1c2nc(\C=C\c3cccc(N)c3)n(C)c2c(=O)n(CCC)c1=O
Show InChI InChI=1S/C20H25N5O2/c1-4-11-24-18-17(19(26)25(12-5-2)20(24)27)23(3)16(22-18)10-9-14-7-6-8-15(21)13-14/h6-10,13H,4-5,11-12,21H2,1-3H3/b10-9+
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 19n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012357
PNG
(2-(5-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-benzo[e]pyrido...)
Show SMILES O=C(CN1CCN(CCCCCN2C(=O)c3ccccc3C2=O)CC1)N1c2ccccc2C(=O)Nc2cccnc12
Show InChI InChI=1S/C31H32N6O4/c38-27(37-26-13-5-4-11-24(26)29(39)33-25-12-8-14-32-28(25)37)21-35-19-17-34(18-20-35)15-6-1-7-16-36-30(40)22-9-2-3-10-23(22)31(36)41/h2-5,8-14H,1,6-7,15-21H2,(H,33,39)
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 20n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-methylscopolamine to muscarinic acetylcholine receptor M2 of rat heart tissue membrane.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012360
PNG
(11-{2-[4-(8-Amino-octyl)-piperazin-1-yl]-acetyl}-5...)
Show SMILES NCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C26H36N6O2/c27-13-7-3-1-2-4-8-15-30-16-18-31(19-17-30)20-24(33)32-23-12-6-5-10-21(23)26(34)29-22-11-9-14-28-25(22)32/h5-6,9-12,14H,1-4,7-8,13,15-20,27H2,(H,29,34)
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 20n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M1 of transfected A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012338
PNG
((6-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-benzo[e]pyrido[3...)
Show SMILES CC(C)(C)OC(=O)NCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C29H40N6O4/c1-29(2,3)39-28(38)31-14-8-4-5-9-16-33-17-19-34(20-18-33)21-25(36)35-24-13-7-6-11-22(24)27(37)32-23-12-10-15-30-26(23)35/h6-7,10-13,15H,4-5,8-9,14,16-21H2,1-3H3,(H,31,38)(H,32,37)
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 21n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-methylscopolamine to muscarinic acetylcholine receptor M2 of rat heart tissue membrane.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012336
PNG
(11-(2-{4-[10-(2-Methoxy-benzylamino)-decyl]-pipera...)
Show SMILES COc1ccccc1CNCCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C36H48N6O3/c1-45-33-19-11-8-15-29(33)27-37-20-12-6-4-2-3-5-7-13-22-40-23-25-41(26-24-40)28-34(43)42-32-18-10-9-16-30(32)36(44)39-31-17-14-21-38-35(31)42/h8-11,14-19,21,37H,2-7,12-13,20,22-28H2,1H3,(H,39,44)
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 22n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M2 of rat heart tissue membranes.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))		BDBM50006713
PNG
(1,3-Dipropyl-8-styryl-3,7-dihydro-purine-2,6-dione...)
Show SMILES CCCn1c2nc(C=Cc3ccccc3)[nH]c2c(=O)n(CCC)c1=O |w:8.8|
Show InChI InChI=1S/C19H22N4O2/c1-3-12-22-17-16(18(24)23(13-4-2)19(22)25)20-15(21-17)11-10-14-8-6-5-7-9-14/h5-11H,3-4,12-13H2,1-2H3,(H,20,21)
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 22n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity at Adenosine A1 receptor in rat brain

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(RAT)		BDBM50012338
PNG
((6-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-benzo[e]pyrido[3...)
Show SMILES CC(C)(C)OC(=O)NCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C29H40N6O4/c1-29(2,3)39-28(38)31-14-8-4-5-9-16-33-17-19-34(20-18-33)21-25(36)35-24-13-7-6-11-22(24)27(37)32-23-12-10-15-30-26(23)35/h6-7,10-13,15H,4-5,8-9,14,16-21H2,1-3H3,(H,31,38)(H,32,37)
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 23n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to muscarinic acetylcholine receptor M4 of rat heart NG108-15 cells

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012345
PNG
(11-{2-[4-(9-Amino-nonyl)-piperazin-1-yl]-acetyl}-5...)
Show SMILES NCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C27H38N6O2/c28-14-8-4-2-1-3-5-9-16-31-17-19-32(20-18-31)21-25(34)33-24-13-7-6-11-22(24)27(35)30-23-12-10-15-29-26(23)33/h6-7,10-13,15H,1-5,8-9,14,16-21,28H2,(H,30,35)
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 24n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M2 of rat heart tissue membranes.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047197
PNG
(8-[(E)-2-(3,5-Dimethoxy-phenyl)-vinyl]-7-methyl-1,...)
Show SMILES CCCn1c2nc(\C=C\c3cc(OC)cc(OC)c3)n(C)c2c(=O)n(CCC)c1=O
Show InChI InChI=1S/C22H28N4O4/c1-6-10-25-20-19(21(27)26(11-7-2)22(25)28)24(3)18(23-20)9-8-15-12-16(29-4)14-17(13-15)30-5/h8-9,12-14H,6-7,10-11H2,1-5H3/b9-8+
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 24n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012345
PNG
(11-{2-[4-(9-Amino-nonyl)-piperazin-1-yl]-acetyl}-5...)
Show SMILES NCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C27H38N6O2/c28-14-8-4-2-1-3-5-9-16-31-17-19-32(20-18-31)21-25(34)33-24-13-7-6-11-22(24)27(35)30-23-12-10-15-29-26(23)33/h6-7,10-13,15H,1-5,8-9,14,16-21,28H2,(H,30,35)
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 24n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M1 of transfected A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012360
PNG
(11-{2-[4-(8-Amino-octyl)-piperazin-1-yl]-acetyl}-5...)
Show SMILES NCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C26H36N6O2/c27-13-7-3-1-2-4-8-15-30-16-18-31(19-17-30)20-24(33)32-23-12-6-5-10-21(23)26(34)29-22-11-9-14-28-25(22)32/h5-6,9-12,14H,1-4,7-8,13,15-20,27H2,(H,29,34)
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 26n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M2 of rat heart tissue membranes.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM39341
PNG
(11-[(4-methylpiperazin-1-yl)acetyl]-5,11-dihydro-6...)
Show SMILES CN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C19H21N5O2/c1-22-9-11-23(12-10-22)13-17(25)24-16-7-3-2-5-14(16)19(26)21-15-6-4-8-20-18(15)24/h2-8H,9-13H2,1H3,(H,21,26)
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 29n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-methylscopolamine to muscarinic acetylcholine receptor M1 of transfected rat A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50006710
PNG
(8-[(E)-2-(3,4-Dimethoxy-phenyl)-vinyl]-7-methyl-1,...)
Show SMILES CCCn1c2nc(\C=C\c3ccc(OC)c(OC)c3)n(C)c2c(=O)n(CCC)c1=O
Show InChI InChI=1S/C22H28N4O4/c1-6-12-25-20-19(21(27)26(13-7-2)22(25)28)24(3)18(23-20)11-9-15-8-10-16(29-4)17(14-15)30-5/h8-11,14H,6-7,12-13H2,1-5H3/b11-9+
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 31n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))		BDBM50047159
PNG
(1,3-Dimethyl-7-phenethyl-8-[2-(3,4,5-trimethoxy-ph...)
Show SMILES COc1cc(\C=C\c2nc3n(C)c(=O)n(C)c(=O)c3n2CCc2ccccc2)cc(OC)c1OC
Show InChI InChI=1S/C26H28N4O5/c1-28-24-22(25(31)29(2)26(28)32)30(14-13-17-9-7-6-8-10-17)21(27-24)12-11-18-15-19(33-3)23(35-5)20(16-18)34-4/h6-12,15-16H,13-14H2,1-5H3/b12-11+
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 32n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Affinity against Adenosine A1 receptor in rat brain using [3H]- PIA as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047160
PNG
(8-[2-(3-Fluoro-phenyl)-vinyl]-7-methyl-1,3-dipropy...)
Show SMILES CCCn1c2nc(\C=C\c3cccc(F)c3)n(C)c2c(=O)n(CCC)c1=O
Show InChI InChI=1S/C20H23FN4O2/c1-4-11-24-18-17(19(26)25(12-5-2)20(24)27)23(3)16(22-18)10-9-14-7-6-8-15(21)13-14/h6-10,13H,4-5,11-12H2,1-3H3/b10-9+
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 33n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012338
PNG
((6-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-benzo[e]pyrido[3...)
Show SMILES CC(C)(C)OC(=O)NCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C29H40N6O4/c1-29(2,3)39-28(38)31-14-8-4-5-9-16-33-17-19-34(20-18-33)21-25(36)35-24-13-7-6-11-22(24)27(37)32-23-12-10-15-30-26(23)35/h6-7,10-13,15H,4-5,8-9,14,16-21H2,1-3H3,(H,31,38)(H,32,37)
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 37n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-methylscopolamine to muscarinic acetylcholine receptor M1 of transfected rat A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047183
PNG
(CHEMBL25859 | N-{3-[2-(1,3,7-Trimethyl-2,6-dioxo-2...)
Show SMILES CC(=O)Nc1cccc(\C=C\c2nc3n(C)c(=O)n(C)c(=O)c3n2C)c1
Show InChI InChI=1S/C18H19N5O3/c1-11(24)19-13-7-5-6-12(10-13)8-9-14-20-16-15(21(14)2)17(25)23(4)18(26)22(16)3/h5-10H,1-4H3,(H,19,24)/b9-8+
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 39n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012371
PNG
(CHEMBL70154 | N-(10-{4-[2-Oxo-2-(6-oxo-5,6-dihydro...)
Show SMILES CC(=O)NCCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C30H42N6O3/c1-24(37)31-16-10-6-4-2-3-5-7-11-18-34-19-21-35(22-20-34)23-28(38)36-27-15-9-8-13-25(27)30(39)33-26-14-12-17-32-29(26)36/h8-9,12-15,17H,2-7,10-11,16,18-23H2,1H3,(H,31,37)(H,33,39)
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 43n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M2 of rat heart tissue membranes.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50006713
PNG
(1,3-Dipropyl-8-styryl-3,7-dihydro-purine-2,6-dione...)
Show SMILES CCCn1c2nc(C=Cc3ccccc3)[nH]c2c(=O)n(CCC)c1=O |w:8.8|
Show InChI InChI=1S/C19H22N4O2/c1-3-12-22-17-16(18(24)23(13-4-2)19(22)25)20-15(21-17)11-10-14-8-6-5-7-9-14/h5-11H,3-4,12-13H2,1-2H3,(H,20,21)
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 44n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)		BDBM50012338
PNG
((6-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-benzo[e]pyrido[3...)
Show SMILES CC(C)(C)OC(=O)NCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C29H40N6O4/c1-29(2,3)39-28(38)31-14-8-4-5-9-16-33-17-19-34(20-18-33)21-25(36)35-24-13-7-6-11-22(24)27(37)32-23-12-10-15-30-26(23)35/h6-7,10-13,15H,4-5,8-9,14,16-21H2,1-3H3,(H,31,38)(H,32,37)
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 46n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-methylscopolamine to muscarinic acetylcholine receptor M3 of transfected rat A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50006711
PNG
(8-[2-(3,4-Dimethoxy-phenyl)-vinyl]-1,3-dipropyl-3,...)
Show SMILES CCCn1c2nc(C=Cc3ccc(OC)c(OC)c3)[nH]c2c(=O)n(CCC)c1=O |w:8.8|
Show InChI InChI=1S/C21H26N4O4/c1-5-11-24-19-18(20(26)25(12-6-2)21(24)27)22-17(23-19)10-8-14-7-9-15(28-3)16(13-14)29-4/h7-10,13H,5-6,11-12H2,1-4H3,(H,22,23)
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 49n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM82376
PNG
(CAS_80880-90-6 | NSC_5387 | TELENZEPINE)
Show SMILES CN1CCN(CC(=O)N2c3c(C)scc3C(=O)Nc3ccccc23)CC1
Show InChI InChI=1S/C19H22N4O2S/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22/h3-6,12H,7-11H2,1-2H3,(H,20,25)
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 50n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-methylscopolamine to muscarinic acetylcholine receptor M2 of rat heart tissue membrane.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012327
PNG
(CHEMBL68292 | N-(9-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-...)
Show SMILES CC(=O)NCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C29H40N6O3/c1-23(36)30-15-9-5-3-2-4-6-10-17-33-18-20-34(21-19-33)22-27(37)35-26-14-8-7-12-24(26)29(38)32-25-13-11-16-31-28(25)35/h7-8,11-14,16H,2-6,9-10,15,17-22H2,1H3,(H,30,36)(H,32,38)
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 50n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M2 of rat heart tissue membranes.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012365
PNG
(11-{2-[4-(2-Chloro-ethyl)-piperazin-1-yl]-acetyl}-...)
Show SMILES ClCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C20H22ClN5O2/c21-7-9-24-10-12-25(13-11-24)14-18(27)26-17-6-2-1-4-15(17)20(28)23-16-5-3-8-22-19(16)26/h1-6,8H,7,9-14H2,(H,23,28)
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 52n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M1 of transfected A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012327
PNG
(CHEMBL68292 | N-(9-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-...)
Show SMILES CC(=O)NCCCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C29H40N6O3/c1-23(36)30-15-9-5-3-2-4-6-10-17-33-18-20-34(21-19-33)22-27(37)35-26-14-8-7-12-24(26)29(38)32-25-13-11-16-31-28(25)35/h7-8,11-14,16H,2-6,9-10,15,17-22H2,1H3,(H,30,36)(H,32,38)
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 52n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M1 of transfected A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047168
PNG
(8-[2-(3,5-Difluoro-phenyl)-vinyl]-7-methyl-1,3-dip...)
Show SMILES CCCn1c2nc(\C=C\c3cc(F)cc(F)c3)n(C)c2c(=O)n(CCC)c1=O
Show InChI InChI=1S/C20H22F2N4O2/c1-4-8-25-18-17(19(27)26(9-5-2)20(25)28)24(3)16(23-18)7-6-13-10-14(21)12-15(22)11-13/h6-7,10-12H,4-5,8-9H2,1-3H3/b7-6+
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 53n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50037429
PNG
(8-(3-chlorostyryl)caffeine | 8-[(E)-2-(3-chlorophe...)
Show SMILES Cn1c(\C=C\c2cccc(Cl)c2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C16H15ClN4O2/c1-19-12(8-7-10-5-4-6-11(17)9-10)18-14-13(19)15(22)21(3)16(23)20(14)2/h4-9H,1-3H3/b8-7+
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 54n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))		BDBM50006713
PNG
(1,3-Dipropyl-8-styryl-3,7-dihydro-purine-2,6-dione...)
Show SMILES CCCn1c2nc(C=Cc3ccccc3)[nH]c2c(=O)n(CCC)c1=O |w:8.8|
Show InChI InChI=1S/C19H22N4O2/c1-3-12-22-17-16(18(24)23(13-4-2)19(22)25)20-15(21-17)11-10-14-8-6-5-7-9-14/h5-11H,3-4,12-13H2,1-2H3,(H,20,21)
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 55n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Affinity against Adenosine A1 receptor in rat brain using [3H]- PIA as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047193
PNG
(7-Methyl-8-[2-(3-nitro-phenyl)-vinyl]-1,3-dipropyl...)
Show SMILES CCCn1c2nc(\C=C\c3cccc(c3)[N+]([O-])=O)n(C)c2c(=O)n(CCC)c1=O
Show InChI InChI=1S/C20H23N5O4/c1-4-11-23-18-17(19(26)24(12-5-2)20(23)27)22(3)16(21-18)10-9-14-7-6-8-15(13-14)25(28)29/h6-10,13H,4-5,11-12H2,1-3H3/b10-9+
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 56n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047201
PNG
(8-[2-(3-Amino-phenyl)-vinyl]-1,3,7-trimethyl-3,7-d...)
Show SMILES Cn1c(\C=C\c2cccc(N)c2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C16H17N5O2/c1-19-12(8-7-10-5-4-6-11(17)9-10)18-14-13(19)15(22)21(3)16(23)20(14)2/h4-9H,17H2,1-3H3/b8-7+
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 57n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)		BDBM50012351
PNG
(11-{2-[4-(7-Amino-heptyl)-piperazin-1-yl]-acetyl}-...)
Show SMILES NCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C25H34N6O2/c26-12-6-2-1-3-7-14-29-15-17-30(18-16-29)19-23(32)31-22-11-5-4-9-20(22)25(33)28-21-10-8-13-27-24(21)31/h4-5,8-11,13H,1-3,6-7,12,14-19,26H2,(H,28,33)
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 57n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M2 of rat heart tissue membranes.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012357
PNG
(2-(5-{4-[2-Oxo-2-(6-oxo-5,6-dihydro-benzo[e]pyrido...)
Show SMILES O=C(CN1CCN(CCCCCN2C(=O)c3ccccc3C2=O)CC1)N1c2ccccc2C(=O)Nc2cccnc12
Show InChI InChI=1S/C31H32N6O4/c38-27(37-26-13-5-4-11-24(26)29(39)33-25-12-8-14-32-28(25)37)21-35-19-17-34(18-20-35)15-6-1-7-16-36-30(40)22-9-2-3-10-23(22)31(36)41/h2-5,8-14H,1,6-7,15-21H2,(H,33,39)
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 60n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-methylscopolamine to muscarinic acetylcholine receptor M1 of transfected rat A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047179
PNG
(8-[2-(3-Chloro-phenyl)-vinyl]-7-methyl-1,3-dipropy...)
Show SMILES CCCn1c2nc(\C=C\c3cccc(Cl)c3)n(C)c2c(=O)n(CCC)c1=O
Show InChI InChI=1S/C20H23ClN4O2/c1-4-11-24-18-17(19(26)25(12-5-2)20(24)27)23(3)16(22-18)10-9-14-7-6-8-15(21)13-14/h6-10,13H,4-5,11-12H2,1-3H3/b10-9+
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 61n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047181
PNG
(1,3-Dipropyl-8-[2-(2,3,4-trimethoxy-phenyl)-vinyl]...)
Show SMILES CCCn1c2nc(C=Cc3ccc(OC)c(OC)c3OC)[nH]c2c(=O)n(CCC)c1=O |w:8.8|
Show InChI InChI=1S/C22H28N4O5/c1-6-12-25-20-17(21(27)26(13-7-2)22(25)28)23-16(24-20)11-9-14-8-10-15(29-3)19(31-5)18(14)30-4/h8-11H,6-7,12-13H2,1-5H3,(H,23,24)
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 64n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047185
PNG
(8-[2-(3,5-Difluoro-phenyl)-vinyl]-1,3,7-trimethyl-...)
Show SMILES Cn1c(\C=C\c2cc(F)cc(F)c2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C16H14F2N4O2/c1-20-12(5-4-9-6-10(17)8-11(18)7-9)19-14-13(20)15(23)22(3)16(24)21(14)2/h4-8H,1-3H3/b5-4+
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 65n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)		BDBM50012351
PNG
(11-{2-[4-(7-Amino-heptyl)-piperazin-1-yl]-acetyl}-...)
Show SMILES NCCCCCCCN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C25H34N6O2/c26-12-6-2-1-3-7-14-29-15-17-30(18-16-29)19-23(32)31-22-11-5-4-9-20(22)25(33)28-21-10-8-13-27-24(21)31/h4-5,8-11,13H,1-3,6-7,12,14-19,26H2,(H,28,33)
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 66n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-N-Methyl-scopolamine to Muscarinic acetylcholine receptor M1 of transfected A9L cells.

J Med Chem 34: 2133-45 (1991)


BindingDB Entry DOI: 10.7270/Q2SJ1JKW
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50047211
PNG
(Acetic acid 2,6-dimethoxy-4-[2-(1,3,7-trimethyl-2,...)
Show SMILES COc1cc(\C=C\c2nc3n(C)c(=O)n(C)c(=O)c3n2C)cc(OC)c1OC(C)=O
Show InChI InChI=1S/C20H22N4O6/c1-11(25)30-17-13(28-5)9-12(10-14(17)29-6)7-8-15-21-18-16(22(15)2)19(26)24(4)20(27)23(18)3/h7-10H,1-6H3/b8-7+
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 68n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat brain using [3H]- CGS 21680 as radioligand

J Med Chem 36: 1333-42 (1993)


BindingDB Entry DOI: 10.7270/Q2BV7FPB
More data for this
Ligand-Target Pair
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