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Compile Data Set for Download or QSAR

Found 17 hits of ec50 for UniProtKB: P22086   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50027031
PNG
((2-Chloro-phenyl)-(4,5-dihydro-1H-imidazol-2-ylmet...)
Show SMILES Clc1ccccc1NCC1=NCCN1
Show InChI InChI=1S/C10H12ClN3/c11-8-3-1-2-4-9(8)14-7-10-12-5-6-13-10/h1-4,14H,5-7H2,(H,12,13)
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n/an/an/an/a 53n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonistic activity against alpha-2 adrenergic receptor in isolated, field -simulated vas deferens from rats


J Med Chem 26: 1769-72 (1984)


Article DOI: 10.1021/jm00366a022
BindingDB Entry DOI: 10.7270/Q2668DRD
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50027035
PNG
(3-[(4,5-Dihydro-1H-imidazol-2-ylmethyl)-amino]-phe...)
Show SMILES Oc1cccc(NCC2=NCCN2)c1
Show InChI InChI=1S/C10H13N3O/c14-9-3-1-2-8(6-9)13-7-10-11-4-5-12-10/h1-3,6,13-14H,4-5,7H2,(H,11,12)
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n/an/an/an/a 74n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor from calf cerebral cortex, using [3H]prazosin as the radioligand


J Med Chem 26: 1769-72 (1984)


Article DOI: 10.1021/jm00366a022
BindingDB Entry DOI: 10.7270/Q2668DRD
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50470860
PNG
(CHEMBL105328)
Show SMILES C1Cc2cccc3cccc(C1c1c[nH]cn1)c23
Show InChI InChI=1S/C16H14N2/c1-3-11-5-2-6-14-13(15-9-17-10-18-15)8-7-12(4-1)16(11)14/h1-6,9-10,13H,7-8H2,(H,17,18)
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n/an/an/an/a 156n/an/an/an/a



Ohio State University

Curated by ChEMBL


Assay Description
50% Molar effective concentration for agonistic activity against Alpha-1 adrenergic receptor in rat aorta


J Med Chem 39: 3001-13 (1996)


Article DOI: 10.1021/jm9506074
BindingDB Entry DOI: 10.7270/Q2BV7KBH
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM31046
PNG
(3-[4,5-dihydro-1H-imidazol-2-ylmethyl-(4-methylphe...)
Show SMILES Cc1ccc(cc1)N(CC1=NCCN1)c1cccc(O)c1
Show InChI InChI=1S/C17H19N3O/c1-13-5-7-14(8-6-13)20(12-17-18-9-10-19-17)15-3-2-4-16(21)11-15/h2-8,11,21H,9-10,12H2,1H3,(H,18,19)
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n/an/an/an/a>1.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonistic activity against alpha alpha-2 adrenergic receptor in isolated, field -simulated vas deferens from rats


J Med Chem 26: 1769-72 (1984)


Article DOI: 10.1021/jm00366a022
BindingDB Entry DOI: 10.7270/Q2668DRD
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50027036
PNG
((4,5-Dihydro-1H-imidazol-2-ylmethyl)-methyl-p-toly...)
Show SMILES CN(CC1=NCCN1)c1ccc(C)cc1
Show InChI InChI=1S/C12H17N3/c1-10-3-5-11(6-4-10)15(2)9-12-13-7-8-14-12/h3-6H,7-9H2,1-2H3,(H,13,14)
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n/an/an/an/a>2.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 adrenergic receptor from calf cerebral cortex, using [3H]prazosin as the radioligand


J Med Chem 26: 1769-72 (1984)


Article DOI: 10.1021/jm00366a022
BindingDB Entry DOI: 10.7270/Q2668DRD
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50027032
PNG
((4,5-Dihydro-1H-imidazol-2-ylmethyl)-p-tolyl-amine...)
Show SMILES Cc1ccc(NCC2=NCCN2)cc1
Show InChI InChI=1S/C11H15N3/c1-9-2-4-10(5-3-9)14-8-11-12-6-7-13-11/h2-5,14H,6-8H2,1H3,(H,12,13)
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n/an/an/an/a>2.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonistic activity against alpha alpha-2 adrenergic receptor in isolated, field -simulated vas deferens from rats


J Med Chem 26: 1769-72 (1984)


Article DOI: 10.1021/jm00366a022
BindingDB Entry DOI: 10.7270/Q2668DRD
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(Rattus norvegicus (rat)-Rattus norvegicus (Rat)-RA...)
BDBM35234
PNG
(DL-[7-3H]norepinephrine | NOREPINEPHRINE | Noradre...)
Show SMILES NCC(O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2
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n/an/an/an/a 3.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]WB4101 from alpha-adrenergic receptor in Sprague-Dawley rat cerebral cortical membrane


J Med Chem 22: 1493-7 (1979)


Article DOI: 10.1021/jm00198a012
BindingDB Entry DOI: 10.7270/Q2RV0RQK
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(Rattus norvegicus (rat)-Rattus norvegicus (Rat)-RA...)
BDBM50019061
PNG
((+/-)4-(2-Amino-1-hydroxy-ethyl)-5-fluoro-benzene-...)
Show SMILES NCC(O)c1cc(O)c(O)cc1F
Show InChI InChI=1S/C8H10FNO3/c9-5-2-7(12)6(11)1-4(5)8(13)3-10/h1-2,8,11-13H,3,10H2
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n/an/an/an/a 3.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]WB4101 from alpha-adrenergic receptor in Sprague-Dawley rat cerebral cortical membrane


J Med Chem 22: 1493-7 (1979)


Article DOI: 10.1021/jm00198a012
BindingDB Entry DOI: 10.7270/Q2RV0RQK
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(Rattus norvegicus (rat)-Rattus norvegicus (Rat)-RA...)
BDBM50019061
PNG
((+/-)4-(2-Amino-1-hydroxy-ethyl)-5-fluoro-benzene-...)
Show SMILES NCC(O)c1cc(O)c(O)cc1F
Show InChI InChI=1S/C8H10FNO3/c9-5-2-7(12)6(11)1-4(5)8(13)3-10/h1-2,8,11-13H,3,10H2
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n/an/an/an/a 5.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonist activity at alpha-adrenergic receptor in Sprague-Dawley rat cerebral cortex assessed as [3H]cAMP accumulation by liquid scintillation spectro...


J Med Chem 22: 1493-7 (1979)


Article DOI: 10.1021/jm00198a012
BindingDB Entry DOI: 10.7270/Q2RV0RQK
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(Rattus norvegicus (rat)-Rattus norvegicus (Rat)-RA...)
BDBM50042998
PNG
(5-(2-Amino-1-hydroxy-ethyl)-3-fluoro-benzene-1,2-d...)
Show SMILES NCC(O)c1cc(O)c(O)c(F)c1
Show InChI InChI=1S/C8H10FNO3/c9-5-1-4(7(12)3-10)2-6(11)8(5)13/h1-2,7,11-13H,3,10H2
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n/an/an/an/a 5.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonist activity at alpha-adrenergic receptor in Sprague-Dawley rat cerebral cortex assessed as [3H]cAMP accumulation by liquid scintillation spectro...


J Med Chem 22: 1493-7 (1979)


Article DOI: 10.1021/jm00198a012
BindingDB Entry DOI: 10.7270/Q2RV0RQK
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(Rattus norvegicus (rat)-Rattus norvegicus (Rat)-RA...)
BDBM35234
PNG
(DL-[7-3H]norepinephrine | NOREPINEPHRINE | Noradre...)
Show SMILES NCC(O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2
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n/an/an/an/a 5.00E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonist activity at alpha-adrenergic receptor in Sprague-Dawley rat cerebral cortex assessed as [3H]cAMP accumulation by liquid scintillation spectro...


J Med Chem 22: 1493-7 (1979)


Article DOI: 10.1021/jm00198a012
BindingDB Entry DOI: 10.7270/Q2RV0RQK
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50027034
PNG
((4,5-Dihydro-1H-imidazol-2-ylmethyl)-phenyl-p-toly...)
Show SMILES Cc1ccc(cc1)N(CC1=NCCN1)c1ccccc1
Show InChI InChI=1S/C17H19N3/c1-14-7-9-16(10-8-14)20(13-17-18-11-12-19-17)15-5-3-2-4-6-15/h2-10H,11-13H2,1H3,(H,18,19)
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n/an/an/an/a>1.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonistic activity against alpha alpha-2 adrenergic receptor in isolated, field -simulated vas deferens from rats


J Med Chem 26: 1769-72 (1984)


Article DOI: 10.1021/jm00366a022
BindingDB Entry DOI: 10.7270/Q2668DRD
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50027033
PNG
(CHEMBL541208 | Cyclohexyl-(4,5-dihydro-1H-imidazol...)
Show SMILES Cc1ccc(cc1)N(CC1=NCCN1)C1CCCCC1
Show InChI InChI=1S/C17H25N3/c1-14-7-9-16(10-8-14)20(13-17-18-11-12-19-17)15-5-3-2-4-6-15/h7-10,15H,2-6,11-13H2,1H3,(H,18,19)
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n/an/an/an/a>1.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonistic activity against alpha alpha-2 adrenergic receptor in isolated, field -simulated vas deferens from rats


J Med Chem 26: 1769-72 (1984)


Article DOI: 10.1021/jm00366a022
BindingDB Entry DOI: 10.7270/Q2668DRD
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50027037
PNG
((4,5-Dihydro-1H-imidazol-2-ylmethyl)-ethyl-p-tolyl...)
Show SMILES CCN(CC1=NCCN1)c1ccc(C)cc1
Show InChI InChI=1S/C13H19N3/c1-3-16(10-13-14-8-9-15-13)12-6-4-11(2)5-7-12/h4-7H,3,8-10H2,1-2H3,(H,14,15)
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n/an/an/an/a>1.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonistic activity against alpha alpha-2 adrenergic receptor in isolated, field -simulated vas deferens from rats


J Med Chem 26: 1769-72 (1984)


Article DOI: 10.1021/jm00366a022
BindingDB Entry DOI: 10.7270/Q2668DRD
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(Rattus norvegicus (rat)-Rattus norvegicus (Rat)-RA...)
BDBM50042998
PNG
(5-(2-Amino-1-hydroxy-ethyl)-3-fluoro-benzene-1,2-d...)
Show SMILES NCC(O)c1cc(O)c(O)c(F)c1
Show InChI InChI=1S/C8H10FNO3/c9-5-1-4(7(12)3-10)2-6(11)8(5)13/h1-2,7,11-13H,3,10H2
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n/an/an/an/a 1.50E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]WB4101 from alpha-adrenergic receptor in Sprague-Dawley rat cerebral cortical membrane


J Med Chem 22: 1493-7 (1979)


Article DOI: 10.1021/jm00198a012
BindingDB Entry DOI: 10.7270/Q2RV0RQK
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(Rattus norvegicus (rat)-Rattus norvegicus (Rat)-RA...)
BDBM50019060
PNG
((+/-)4-(2-Amino-1-hydroxy-ethyl)-3-fluoro-benzene-...)
Show SMILES NCC(O)c1ccc(O)c(O)c1F
Show InChI InChI=1S/C8H10FNO3/c9-7-4(6(12)3-10)1-2-5(11)8(7)13/h1-2,6,11-13H,3,10H2
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n/an/an/an/a>1.00E+5n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]WB4101 from alpha-adrenergic receptor in Sprague-Dawley rat cerebral cortical membrane


J Med Chem 22: 1493-7 (1979)


Article DOI: 10.1021/jm00198a012
BindingDB Entry DOI: 10.7270/Q2RV0RQK
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(Rattus norvegicus (rat)-Rattus norvegicus (Rat)-RA...)
BDBM50019060
PNG
((+/-)4-(2-Amino-1-hydroxy-ethyl)-3-fluoro-benzene-...)
Show SMILES NCC(O)c1ccc(O)c(O)c1F
Show InChI InChI=1S/C8H10FNO3/c9-7-4(6(12)3-10)1-2-5(11)8(7)13/h1-2,6,11-13H,3,10H2
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TBA

Curated by ChEMBL


Assay Description
Agonist activity at alpha-adrenergic receptor in Sprague-Dawley rat cerebral cortex assessed as [3H]cAMP accumulation by liquid scintillation spectro...


J Med Chem 22: 1493-7 (1979)


Article DOI: 10.1021/jm00198a012
BindingDB Entry DOI: 10.7270/Q2RV0RQK
More data for this
Ligand-Target Pair