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PubMed code 8101878

Compile data set for download or QSAR
Found 61 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
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230846
PNG
(CHEMBL2114071)
Show SMILES CN1C(=O)N2C(CN3CCN(CC3)c3ccccc3Cl)CN=C2c2ccccc12
Show InChI InChI=1S/C22H24ClN5O/c1-25-19-8-4-2-6-17(19)21-24-14-16(28(21)22(25)29)15-26-10-12-27(13-11-26)20-9-5-3-7-18(20)23/h2-9,16H,10-15H2,1H3
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0.0680n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230859
PNG
(CHEMBL309150)
Show SMILES COC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3OC)CN12
Show InChI InChI=1S/C23H27N5O2/c1-29-21-10-6-5-9-20(21)27-13-11-26(12-14-27)15-17-16-28-22(24-17)18-7-3-4-8-19(18)25-23(28)30-2/h3-10,17H,11-16H2,1-2H3
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0.0700n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230848
PNG
(CHEMBL70872)
Show SMILES COC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3Cl)CN12
Show InChI InChI=1S/C22H24ClN5O/c1-29-22-25-19-8-4-2-6-17(19)21-24-16(15-28(21)22)14-26-10-12-27(13-11-26)20-9-5-3-7-18(20)23/h2-9,16H,10-15H2,1H3
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0.110n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM29568
PNG
(CHEMBL2 | PRAZOSIN | PRAZOSIN HYDROCHLORIDE | [3H]...)
Show SMILES COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)c1ccco1
Show InChI InChI=1S/C19H21N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h3-4,9-11H,5-8H2,1-2H3,(H2,20,21,22)
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0.190n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50066109
PNG
(3-[4-(2-Methoxy-phenyl)-piperazin-1-ylmethyl]-2,6-...)
Show SMILES COc1ccccc1N1CCN(CC2CN=C3N2C(=O)Nc2ccccc32)CC1
Show InChI InChI=1S/C22H25N5O2/c1-29-20-9-5-4-8-19(20)26-12-10-25(11-13-26)15-16-14-23-21-17-6-2-3-7-18(17)24-22(28)27(16)21/h2-9,16H,10-15H2,1H3,(H,24,28)
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0.210n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50040253
PNG
(3-{2-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-ethyl}-...)
Show SMILES COc1ccccc1N1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)CC1
Show InChI InChI=1S/C21H24N4O3/c1-28-19-9-5-4-8-18(19)24-13-10-23(11-14-24)12-15-25-20(26)16-6-2-3-7-17(16)22-21(25)27/h2-9H,10-15H2,1H3,(H,22,27)
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0.25n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230844
PNG
(CHEMBL71470)
Show SMILES COc1ccccc1N1CCN(CC2CN3C(=N2)c2ccccc2N=C3SC)CC1
Show InChI InChI=1S/C23H27N5OS/c1-29-21-10-6-5-9-20(21)27-13-11-26(12-14-27)15-17-16-28-22(24-17)18-7-3-4-8-19(18)25-23(28)30-2/h3-10,17H,11-16H2,1-2H3
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0.340n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230870
PNG
(CHEMBL70498)
Show SMILES CSC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3Cl)CN12
Show InChI InChI=1S/C22H24ClN5S/c1-29-22-25-19-8-4-2-6-17(19)21-24-16(15-28(21)22)14-26-10-12-27(13-11-26)20-9-5-3-7-18(20)23/h2-9,16H,10-15H2,1H3
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0.340n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230861
PNG
(CHEMBL2114072)
Show SMILES COc1ccccc1N1CCN(CC2CN=C3N2C(=O)N(C)c2ccccc32)CC1
Show InChI InChI=1S/C23H27N5O2/c1-25-19-8-4-3-7-18(19)22-24-15-17(28(22)23(25)29)16-26-11-13-27(14-12-26)20-9-5-6-10-21(20)30-2/h3-10,17H,11-16H2,1-2H3
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0.360n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230853
PNG
(CHEMBL304165)
Show SMILES COc1ccccc1N1CCN(CC2CN3C(=N2)c2ccccc2N(C)C3=O)CC1
Show InChI InChI=1S/C23H27N5O2/c1-25-19-8-4-3-7-18(19)22-24-17(16-28(22)23(25)29)15-26-11-13-27(14-12-26)20-9-5-6-10-21(20)30-2/h3-10,17H,11-16H2,1-2H3
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0.370n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230847
PNG
(CHEMBL2114069)
Show SMILES Clc1ccccc1N1CCN(CC2CN=C3N2C(=O)Nc2ccccc32)CC1
Show InChI InChI=1S/C21H22ClN5O/c22-17-6-2-4-8-19(17)26-11-9-25(10-12-26)14-15-13-23-20-16-5-1-3-7-18(16)24-21(28)27(15)20/h1-8,15H,9-14H2,(H,24,28)
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0.580n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230851
PNG
(CHEMBL70347)
Show SMILES CN1C(=O)N2CC(CN3CCN(CC3)c3ccccc3Cl)N=C2c2ccccc12
Show InChI InChI=1S/C22H24ClN5O/c1-25-19-8-4-2-6-17(19)21-24-16(15-28(21)22(25)29)14-26-10-12-27(13-11-26)20-9-5-3-7-18(20)23/h2-9,16H,10-15H2,1H3
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0.680n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230850
PNG
(CHEMBL309149)
Show SMILES Clc1ccccc1N1CCN(CC2CN3C(=N2)c2ccccc2NC3=O)CC1
Show InChI InChI=1S/C21H22ClN5O/c22-17-6-2-4-8-19(17)26-11-9-25(10-12-26)13-15-14-27-20(23-15)16-5-1-3-7-18(16)24-21(27)28/h1-8,15H,9-14H2,(H,24,28)
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1.10n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50040260
PNG
(2-[4-(2-Methoxy-phenyl)-piperazin-1-ylmethyl]-2,6-...)
Show SMILES COc1ccccc1N1CCN(CC2CN3C(=N2)c2ccccc2NC3=O)CC1
Show InChI InChI=1S/C22H25N5O2/c1-29-20-9-5-4-8-19(20)26-12-10-25(11-13-26)14-16-15-27-21(23-16)17-6-2-3-7-18(17)24-22(27)28/h2-9,16H,10-15H2,1H3,(H,24,28)
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1.30n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230871
PNG
(CHEMBL307961)
Show SMILES COC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3)CN12
Show InChI InChI=1S/C22H25N5O/c1-28-22-24-20-10-6-5-9-19(20)21-23-17(16-27(21)22)15-25-11-13-26(14-12-25)18-7-3-2-4-8-18/h2-10,17H,11-16H2,1H3
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1.40n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230874
PNG
(CHEMBL2114070)
Show SMILES O=C1Nc2ccccc2C2=NCC(CN3CCN(CC3)c3ccccc3)N12
Show InChI InChI=1S/C21H23N5O/c27-21-23-19-9-5-4-8-18(19)20-22-14-17(26(20)21)15-24-10-12-25(13-11-24)16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H,23,27)
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1.70n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230872
PNG
(CHEMBL71492)
Show SMILES O=C1Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3)CN12
Show InChI InChI=1S/C21H23N5O/c27-21-23-19-9-5-4-8-18(19)20-22-16(15-26(20)21)14-24-10-12-25(13-11-24)17-6-2-1-3-7-17/h1-9,16H,10-15H2,(H,23,27)
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2n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230867
PNG
(CHEMBL2114065)
Show SMILES COc1cccc(c1)N1CCN(CC2CN=C3N2C(=O)Nc2ccccc32)CC1
Show InChI InChI=1S/C22H25N5O2/c1-29-18-6-4-5-16(13-18)26-11-9-25(10-12-26)15-17-14-23-21-19-7-2-3-8-20(19)24-22(28)27(17)21/h2-8,13,17H,9-12,14-15H2,1H3,(H,24,28)
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5.80n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230855
PNG
(CHEMBL308089)
Show SMILES CSC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3)CN12
Show InChI InChI=1S/C22H25N5S/c1-28-22-24-20-10-6-5-9-19(20)21-23-17(16-27(21)22)15-25-11-13-26(14-12-25)18-7-3-2-4-8-18/h2-10,17H,11-16H2,1H3
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>10n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230849
PNG
(CHEMBL71207)
Show SMILES CN1C(=O)N2CC(CN3CCN(CC3)c3ccccc3)N=C2c2ccccc12
Show InChI InChI=1S/C22H25N5O/c1-24-20-10-6-5-9-19(20)21-23-17(16-27(21)22(24)28)15-25-11-13-26(14-12-25)18-7-3-2-4-8-18/h2-10,17H,11-16H2,1H3
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11n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230858
PNG
(CHEMBL70928)
Show SMILES Fc1ccc(cc1)N1CCN(CC2CN3C(=N2)c2ccccc2NC3=O)CC1
Show InChI InChI=1S/C21H22FN5O/c22-15-5-7-17(8-6-15)26-11-9-25(10-12-26)13-16-14-27-20(23-16)18-3-1-2-4-19(18)24-21(27)28/h1-8,16H,9-14H2,(H,24,28)
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14n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230845
PNG
(CHEMBL2114073)
Show SMILES CN1C(=O)N2C(CN3CCN(CC3)c3ccccc3)CN=C2c2ccccc12
Show InChI InChI=1S/C22H25N5O/c1-24-20-10-6-5-9-19(20)21-23-15-18(27(21)22(24)28)16-25-11-13-26(14-12-25)17-7-3-2-4-8-17/h2-10,18H,11-16H2,1H3
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15n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230862
PNG
(CHEMBL70821)
Show SMILES COc1cccc(c1)N1CCN(CC2CN3C(=N2)c2ccccc2N(C)C3=O)CC1
Show InChI InChI=1S/C23H27N5O2/c1-25-21-9-4-3-8-20(21)22-24-17(16-28(22)23(25)29)15-26-10-12-27(13-11-26)18-6-5-7-19(14-18)30-2/h3-9,14,17H,10-13,15-16H2,1-2H3
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19n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230857
PNG
(CHEMBL70838)
Show SMILES COc1cc2NC(=O)N3CC(CN4CCN(CC4)c4ccccc4)N=C3c2cc1OC
Show InChI InChI=1S/C23H27N5O3/c1-30-20-12-18-19(13-21(20)31-2)25-23(29)28-15-16(24-22(18)28)14-26-8-10-27(11-9-26)17-6-4-3-5-7-17/h3-7,12-13,16H,8-11,14-15H2,1-2H3,(H,25,29)
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30n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230854
PNG
(CHEMBL304812)
Show SMILES O=C1Nc2ccccc2C2=NC(CN3CCC(Cc4ccccc4)CC3)CN12
Show InChI InChI=1S/C23H26N4O/c28-23-25-21-9-5-4-8-20(21)22-24-19(16-27(22)23)15-26-12-10-18(11-13-26)14-17-6-2-1-3-7-17/h1-9,18-19H,10-16H2,(H,25,28)
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36n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230866
PNG
(CHEMBL305434)
Show SMILES COc1cccc(c1)N1CCN(CC2CN3C(=N2)c2ccccc2N=C3SC)CC1
Show InChI InChI=1S/C23H27N5OS/c1-29-19-7-5-6-18(14-19)27-12-10-26(11-13-27)15-17-16-28-22(24-17)20-8-3-4-9-21(20)25-23(28)30-2/h3-9,14,17H,10-13,15-16H2,1-2H3
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49n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230852
PNG
(CHEMBL2114074)
Show SMILES COc1ccc(cc1)N1CCN(CC2CN=C3N2C(=O)Nc2ccccc32)CC1
Show InChI InChI=1S/C22H25N5O2/c1-29-18-8-6-16(7-9-18)26-12-10-25(11-13-26)15-17-14-23-21-19-4-2-3-5-20(19)24-22(28)27(17)21/h2-9,17H,10-15H2,1H3,(H,24,28)
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>50n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230868
PNG
(CHEMBL306582)
Show SMILES O=C1Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccn3)CN12
Show InChI InChI=1S/C20H22N6O/c27-20-23-17-6-2-1-5-16(17)19-22-15(14-26(19)20)13-24-9-11-25(12-10-24)18-7-3-4-8-21-18/h1-8,15H,9-14H2,(H,23,27)
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96n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230863
PNG
(CHEMBL303708)
Show SMILES O=C1Nc2ccccc2C2=NC(CN3CCN(Cc4ccc5OCOc5c4)CC3)CN12
Show InChI InChI=1S/C23H25N5O3/c29-23-25-19-4-2-1-3-18(19)22-24-17(14-28(22)23)13-27-9-7-26(8-10-27)12-16-5-6-20-21(11-16)31-15-30-20/h1-6,11,17H,7-10,12-15H2,(H,25,29)
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>100n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230873
PNG
(CHEMBL431571)
Show SMILES COc1ccc(cc1)N1CCN(CC2CN3C(=N2)c2ccccc2N=C3SC)CC1
Show InChI InChI=1S/C23H27N5OS/c1-29-19-9-7-18(8-10-19)27-13-11-26(12-14-27)15-17-16-28-22(24-17)20-5-3-4-6-21(20)25-23(28)30-2/h3-10,17H,11-16H2,1-2H3
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>100n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230869
PNG
(CHEMBL68213)
Show SMILES COc1ccc(cc1)N1CCN(CC2CN3C(=N2)c2ccccc2NC3=O)CC1
Show InChI InChI=1S/C22H25N5O2/c1-29-18-8-6-17(7-9-18)26-12-10-25(11-13-26)14-16-15-27-21(23-16)19-4-2-3-5-20(19)24-22(27)28/h2-9,16H,10-15H2,1H3,(H,24,28)
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>100n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230856
PNG
(CHEMBL70387)
Show SMILES COC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccc(OC)cc3)CN12
Show InChI InChI=1S/C23H27N5O2/c1-29-19-9-7-18(8-10-19)27-13-11-26(12-14-27)15-17-16-28-22(24-17)20-5-3-4-6-21(20)25-23(28)30-2/h3-10,17H,11-16H2,1-2H3
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>100n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230864
PNG
(CHEMBL71603)
Show SMILES COC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3cccc(OC)c3)CN12
Show InChI InChI=1S/C23H27N5O2/c1-29-19-7-5-6-18(14-19)27-12-10-26(11-13-27)15-17-16-28-22(24-17)20-8-3-4-9-21(20)25-23(28)30-2/h3-9,14,17H,10-13,15-16H2,1-2H3
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>100n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230848
PNG
(CHEMBL70872)
Show SMILES COC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3Cl)CN12
Show InChI InChI=1S/C22H24ClN5O/c1-29-22-25-19-8-4-2-6-17(19)21-24-16(15-28(21)22)14-26-10-12-27(13-11-26)20-9-5-3-7-18(20)23/h2-9,16H,10-15H2,1H3
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116n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230876
PNG
(CHEMBL70900)
Show SMILES SC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3)CN12
Show InChI InChI=1S/C21H23N5S/c27-21-23-19-9-5-4-8-18(19)20-22-16(15-26(20)21)14-24-10-12-25(13-11-24)17-6-2-1-3-7-17/h1-9,16H,10-15H2,(H,23,27)
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158n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230870
PNG
(CHEMBL70498)
Show SMILES CSC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3Cl)CN12
Show InChI InChI=1S/C22H24ClN5S/c1-29-22-25-19-8-4-2-6-17(19)21-24-16(15-28(21)22)14-26-10-12-27(13-11-26)20-9-5-3-7-18(20)23/h2-9,16H,10-15H2,1H3
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223n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230860
PNG
(CHEMBL308051)
Show SMILES O=C1Nc2ccccc2C2=NC(CN3CCC4(CCCCC4)CC3)CN12
Show InChI InChI=1S/C21H28N4O/c26-20-23-18-7-3-2-6-17(18)19-22-16(15-25(19)20)14-24-12-10-21(11-13-24)8-4-1-5-9-21/h2-3,6-7,16H,1,4-5,8-15H2,(H,23,26)
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251n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230867
PNG
(CHEMBL2114065)
Show SMILES COc1cccc(c1)N1CCN(CC2CN=C3N2C(=O)Nc2ccccc32)CC1
Show InChI InChI=1S/C22H25N5O2/c1-29-18-6-4-5-16(13-18)26-11-9-25(10-12-26)15-17-14-23-21-19-7-2-3-8-20(19)24-22(28)27(17)21/h2-8,13,17H,9-12,14-15H2,1H3,(H,24,28)
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302n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230847
PNG
(CHEMBL2114069)
Show SMILES Clc1ccccc1N1CCN(CC2CN=C3N2C(=O)Nc2ccccc32)CC1
Show InChI InChI=1S/C21H22ClN5O/c22-17-6-2-4-8-19(17)26-11-9-25(10-12-26)14-15-13-23-20-16-5-1-3-7-18(16)24-21(28)27(15)20/h1-8,15H,9-14H2,(H,24,28)
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387n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230858
PNG
(CHEMBL70928)
Show SMILES Fc1ccc(cc1)N1CCN(CC2CN3C(=N2)c2ccccc2NC3=O)CC1
Show InChI InChI=1S/C21H22FN5O/c22-15-5-7-17(8-6-15)26-11-9-25(10-12-26)13-16-14-27-20(23-16)18-3-1-2-4-19(18)24-21(27)28/h1-8,16H,9-14H2,(H,24,28)
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391n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230859
PNG
(CHEMBL309150)
Show SMILES COC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3OC)CN12
Show InChI InChI=1S/C23H27N5O2/c1-29-21-10-6-5-9-20(21)27-13-11-26(12-14-27)15-17-16-28-22(24-17)18-7-3-4-8-19(18)25-23(28)30-2/h3-10,17H,11-16H2,1-2H3
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472n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230851
PNG
(CHEMBL70347)
Show SMILES CN1C(=O)N2CC(CN3CCN(CC3)c3ccccc3Cl)N=C2c2ccccc12
Show InChI InChI=1S/C22H24ClN5O/c1-25-19-8-4-2-6-17(19)21-24-16(15-28(21)22(25)29)14-26-10-12-27(13-11-26)20-9-5-3-7-18(20)23/h2-9,16H,10-15H2,1H3
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473n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230875
PNG
(CHEMBL305286)
Show SMILES O=C1Nc2ccccc2C2=NC(CNC3CCN(Cc4ccccc4)CC3)CN12
Show InChI InChI=1S/C23H27N5O/c29-23-26-21-9-5-4-8-20(21)22-25-19(16-28(22)23)14-24-18-10-12-27(13-11-18)15-17-6-2-1-3-7-17/h1-9,18-19,24H,10-16H2,(H,26,29)
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586n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50066109
PNG
(3-[4-(2-Methoxy-phenyl)-piperazin-1-ylmethyl]-2,6-...)
Show SMILES COc1ccccc1N1CCN(CC2CN=C3N2C(=O)Nc2ccccc32)CC1
Show InChI InChI=1S/C22H25N5O2/c1-29-20-9-5-4-8-19(20)26-12-10-25(11-13-26)15-16-14-23-21-17-6-2-3-7-18(17)24-22(28)27(16)21/h2-9,16H,10-15H2,1H3,(H,24,28)
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593n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230846
PNG
(CHEMBL2114071)
Show SMILES CN1C(=O)N2C(CN3CCN(CC3)c3ccccc3Cl)CN=C2c2ccccc12
Show InChI InChI=1S/C22H24ClN5O/c1-25-19-8-4-2-6-17(19)21-24-14-16(28(21)22(25)29)15-26-10-12-27(13-11-26)20-9-5-3-7-18(20)23/h2-9,16H,10-15H2,1H3
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810n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50230865
PNG
(CHEMBL68675)
Show SMILES O=C1Nc2ccccc2C2=NC(CN3CCN(Cc4ccccc4)CC3)CN12
Show InChI InChI=1S/C22H25N5O/c28-22-24-20-9-5-4-8-19(20)21-23-18(16-27(21)22)15-26-12-10-25(11-13-26)14-17-6-2-1-3-7-17/h1-9,18H,10-16H2,(H,24,28)
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850n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-1 adrenergic receptor by measuring displacement of [3H]prazosin from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230871
PNG
(CHEMBL307961)
Show SMILES COC1=Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3)CN12
Show InChI InChI=1S/C22H25N5O/c1-28-22-24-20-10-6-5-9-19(20)21-23-17(16-27(21)22)15-25-11-13-26(14-12-25)18-7-3-2-4-8-18/h2-10,17H,11-16H2,1H3
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952n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230874
PNG
(CHEMBL2114070)
Show SMILES O=C1Nc2ccccc2C2=NCC(CN3CCN(CC3)c3ccccc3)N12
Show InChI InChI=1S/C21H23N5O/c27-21-23-19-9-5-4-8-18(19)20-22-14-17(26(20)21)15-24-10-12-25(13-11-24)16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H,23,27)
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962n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230861
PNG
(CHEMBL2114072)
Show SMILES COc1ccccc1N1CCN(CC2CN=C3N2C(=O)N(C)c2ccccc32)CC1
Show InChI InChI=1S/C23H27N5O2/c1-25-19-8-4-3-7-18(19)22-24-15-17(28(22)23(25)29)16-26-11-13-27(14-12-26)20-9-5-6-10-21(20)30-2/h3-10,17H,11-16H2,1-2H3
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1.42E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50040253
PNG
(3-{2-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-ethyl}-...)
Show SMILES COc1ccccc1N1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)CC1
Show InChI InChI=1S/C21H24N4O3/c1-28-19-9-5-4-8-18(19)24-13-10-23(11-14-24)12-15-25-20(26)16-6-2-3-7-17(16)22-21(25)27/h2-9H,10-15H2,1H3,(H,22,27)
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1.60E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230857
PNG
(CHEMBL70838)
Show SMILES COc1cc2NC(=O)N3CC(CN4CCN(CC4)c4ccccc4)N=C3c2cc1OC
Show InChI InChI=1S/C23H27N5O3/c1-30-20-12-18-19(13-21(20)31-2)25-23(29)28-15-16(24-22(18)28)14-26-8-10-27(11-9-26)17-6-4-3-5-7-17/h3-7,12-13,16H,8-11,14-15H2,1-2H3,(H,25,29)
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1.69E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230853
PNG
(CHEMBL304165)
Show SMILES COc1ccccc1N1CCN(CC2CN3C(=N2)c2ccccc2N(C)C3=O)CC1
Show InChI InChI=1S/C23H27N5O2/c1-25-19-8-4-3-7-18(19)22-24-17(16-28(22)23(25)29)15-26-11-13-27(14-12-26)20-9-5-6-10-21(20)30-2/h3-10,17H,11-16H2,1-2H3
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1.74E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230844
PNG
(CHEMBL71470)
Show SMILES COc1ccccc1N1CCN(CC2CN3C(=N2)c2ccccc2N=C3SC)CC1
Show InChI InChI=1S/C23H27N5OS/c1-29-21-10-6-5-9-20(21)27-13-11-26(12-14-27)15-17-16-28-22(24-17)18-7-3-4-8-19(18)25-23(28)30-2/h3-10,17H,11-16H2,1-2H3
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1.78E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230850
PNG
(CHEMBL309149)
Show SMILES Clc1ccccc1N1CCN(CC2CN3C(=N2)c2ccccc2NC3=O)CC1
Show InChI InChI=1S/C21H22ClN5O/c22-17-6-2-4-8-19(17)26-11-9-25(10-12-26)13-15-14-27-20(23-15)16-5-1-3-7-18(16)24-21(27)28/h1-8,15H,9-14H2,(H,24,28)
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3.17E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230849
PNG
(CHEMBL71207)
Show SMILES CN1C(=O)N2CC(CN3CCN(CC3)c3ccccc3)N=C2c2ccccc12
Show InChI InChI=1S/C22H25N5O/c1-24-20-10-6-5-9-19(20)21-23-17(16-27(21)22(24)28)15-25-11-13-26(14-12-25)18-7-3-2-4-8-18/h2-10,17H,11-16H2,1H3
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3.33E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50040260
PNG
(2-[4-(2-Methoxy-phenyl)-piperazin-1-ylmethyl]-2,6-...)
Show SMILES COc1ccccc1N1CCN(CC2CN3C(=N2)c2ccccc2NC3=O)CC1
Show InChI InChI=1S/C22H25N5O2/c1-29-20-9-5-4-8-19(20)26-12-10-25(11-13-26)14-16-15-27-21(23-16)17-6-2-3-7-18(17)24-22(27)28/h2-9,16H,10-15H2,1H3,(H,24,28)
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3.45E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230872
PNG
(CHEMBL71492)
Show SMILES O=C1Nc2ccccc2C2=NC(CN3CCN(CC3)c3ccccc3)CN12
Show InChI InChI=1S/C21H23N5O/c27-21-23-19-9-5-4-8-18(19)20-22-16(15-26(20)21)14-24-10-12-25(13-11-24)17-6-2-1-3-7-17/h1-9,16H,10-15H2,(H,23,27)
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3.86E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM29568
PNG
(CHEMBL2 | PRAZOSIN | PRAZOSIN HYDROCHLORIDE | [3H]...)
Show SMILES COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)c1ccco1
Show InChI InChI=1S/C19H21N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h3-4,9-11H,5-8H2,1-2H3,(H2,20,21,22)
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4.83E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230854
PNG
(CHEMBL304812)
Show SMILES O=C1Nc2ccccc2C2=NC(CN3CCC(Cc4ccccc4)CC3)CN12
Show InChI InChI=1S/C23H26N4O/c28-23-25-21-9-5-4-8-20(21)22-24-19(16-27(22)23)15-26-12-10-18(11-13-26)14-17-6-2-1-3-7-17/h1-9,18-19H,10-16H2,(H,25,28)
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5.01E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230866
PNG
(CHEMBL305434)
Show SMILES COc1cccc(c1)N1CCN(CC2CN3C(=N2)c2ccccc2N=C3SC)CC1
Show InChI InChI=1S/C23H27N5OS/c1-29-19-7-5-6-18(14-19)27-12-10-26(11-13-27)15-17-16-28-22(24-17)20-8-3-4-9-21(20)25-23(28)30-2/h3-9,14,17H,10-13,15-16H2,1-2H3
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8.36E+3n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50230865
PNG
(CHEMBL68675)
Show SMILES O=C1Nc2ccccc2C2=NC(CN3CCN(Cc4ccccc4)CC3)CN12
Show InChI InChI=1S/C22H25N5O/c28-22-24-20-9-5-4-8-19(20)21-23-18(16-27(21)22)15-26-12-10-25(11-13-26)14-17-6-2-1-3-7-17/h1-9,18H,10-16H2,(H,24,28)
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>1.00E+4n/an/an/an/an/an/an/an/a



National Defense Medical Center

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor by measuring displacement of [3H]clonidine from rat brain cortex membranes (in vitro).


J Med Chem 36: 2196-207 (1993)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%