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Compile Data Set for Download or QSAR

Found 1438 hits Enz. Inhib. hit(s) with Target = 'Adrenergic receptor alpha-2'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50052880
PNG
(CHEMBL49137 | Imidazolidin-2-ylidene-(5-methyl-qui...)
Show SMILES Cc1c(ccc2nccnc12)N=C1NCCN1
Show InChI InChI=1S/C12H13N5/c1-8-9(17-12-15-6-7-16-12)2-3-10-11(8)14-5-4-13-10/h2-5H,6-7H2,1H3,(H2,15,16,17)
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n/an/an/an/a 0.300n/an/an/an/a


TBA

Assay Description
Inhibition of Alpha-2 adrenergic receptor induced contractile response of rabbit vas deferens


Citation and Details

BindingDB Entry DOI: 10.7270/Q22J6F1V
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50213212
PNG
(CHEMBL50390)
Show SMILES Cc1c(NC2=NCCN2)ccc2OCCOc12
Show InChI InChI=1S/C12H15N3O2/c1-8-9(15-12-13-4-5-14-12)2-3-10-11(8)17-7-6-16-10/h2-3H,4-7H2,1H3,(H2,13,14,15)
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n/an/an/an/a 0.350n/an/an/an/a


TBA

Assay Description
Inhibition of Alpha-2 adrenergic receptor induced contractile response of rabbit vas deferens


Citation and Details

BindingDB Entry DOI: 10.7270/Q22J6F1V
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM34572
PNG
(BRIMONIDINE | CHEMBL844 | MLS000069370 | SMR000058...)
Show SMILES Brc1c(NC2=NCCN2)ccc2nccnc12
Show InChI InChI=1S/C11H10BrN5/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8/h1-4H,5-6H2,(H2,15,16,17)
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n/an/an/an/a 1n/an/an/an/a


TBA

Assay Description
Inhibition of Alpha-2 adrenergic receptor induced contractile response of rabbit vas deferens


Citation and Details

BindingDB Entry DOI: 10.7270/Q22J6F1V
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50052882
PNG
(AGN-193080 | CHEMBL298936 | Imidazolidin-2-ylidene...)
Show SMILES Cc1c(ccc2OCCNc12)N=C1NCCN1
Show InChI InChI=1S/C12H16N4O/c1-8-9(16-12-14-4-5-15-12)2-3-10-11(8)13-6-7-17-10/h2-3,13H,4-7H2,1H3,(H2,14,15,16)
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n/an/an/an/a 1.20n/an/an/an/a


TBA

Assay Description
Inhibition of Alpha-2 adrenergic receptor induced contractile response of rabbit vas deferens


Citation and Details

BindingDB Entry DOI: 10.7270/Q22J6F1V
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50052881
PNG
(AGN-192172 | CHEMBL49284 | Imidazolidin-2-ylidene-...)
Show SMILES Cc1c(ccc2NCCNc12)N=C1NCCN1
Show InChI InChI=1S/C12H17N5/c1-8-9(17-12-15-6-7-16-12)2-3-10-11(8)14-5-4-13-10/h2-3,13-14H,4-7H2,1H3,(H2,15,16,17)
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n/an/an/an/a 3.5n/an/an/an/a


TBA

Assay Description
Inhibition of Alpha-2 adrenergic receptor induced contractile response of rabbit vas deferens


Citation and Details

BindingDB Entry DOI: 10.7270/Q22J6F1V
More data for this
Ligand-Target Pair
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


(Homo sapiens (Human))
BDBM50019057
PNG
((+/-)4-Fluoro-5-(1-hydroxy-2-methylamino-ethyl)-be...)
Show SMILES CNCC(O)c1cc(O)c(O)cc1F
Show InChI InChI=1S/C9H12FNO3/c1-11-4-9(14)5-2-7(12)8(13)3-6(5)10/h2-3,9,11-14H,4H2,1H3
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n/an/an/an/a 100n/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Agonistic potency at beta-1 adrenergic receptor for the percent maximal increase in contraction rate of isolated guinea pig atria


J Med Chem 31: 1972-7 (1988)


Article DOI: 10.1021/jm00118a019
BindingDB Entry DOI: 10.7270/Q2V69K54
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


(Homo sapiens (Human))
BDBM50476638
PNG
(CHEMBL75389)
Show SMILES C(c1ccc(NC2=NCCN2)cc1)c1ccc(NC2=NCCN2)cc1
Show InChI InChI=1S/C19H22N6/c1-5-16(24-18-20-9-10-21-18)6-2-14(1)13-15-3-7-17(8-4-15)25-19-22-11-12-23-19/h1-8H,9-13H2,(H2,20,21,24)(H2,22,23,25)
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n/an/an/an/a 166n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at human brain adrenergic alpha2 receptor by [35S]GTPgammaS binding assay


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50029050
PNG
((-)-(R)-epinephrine | (-)-3,4-dihydroxy-alpha-((me...)
Show SMILES CNC[C@H](O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m0/s1
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n/an/an/an/a 300n/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Agonistic potency at alpha 2-Adrenergic receptor for inhibition of 10 uM forskolin-elicited stimulation of adenylate cyclase in human platelet membra...


J Med Chem 31: 1972-7 (1988)


Article DOI: 10.1021/jm00118a019
BindingDB Entry DOI: 10.7270/Q2V69K54
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50270853
PNG
(CHEMBL4128374)
Show SMILES Cl.NC(=N)Nc1cc2CCCc2s1
Show InChI InChI=1S/C8H11N3S/c9-8(10)11-7-4-5-2-1-3-6(5)12-7/h4H,1-3H2,(H4,9,10,11)
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n/an/an/an/a 500n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Activity at alpha2 adrenergic receptor in human brain prefrontal cortex membranes assessed as effect on UK14304-induced [35S]GTPgammaS binding by mea...


Eur J Med Chem 138: 38-50 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.008
BindingDB Entry DOI: 10.7270/Q2BV7K3C
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50270852
PNG
(CHEMBL4125770)
Show SMILES Cl.NC(=N)Nc1cc2CCCCc2s1
Show InChI InChI=1S/C9H13N3S/c10-9(11)12-8-5-6-3-1-2-4-7(6)13-8/h5H,1-4H2,(H4,10,11,12)
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n/an/an/an/a 800n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Activity at alpha2 adrenergic receptor in human brain prefrontal cortex membranes assessed as effect on UK14304-induced [35S]GTPgammaS binding by mea...


Eur J Med Chem 138: 38-50 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.008
BindingDB Entry DOI: 10.7270/Q2BV7K3C
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


(Homo sapiens (Human))
BDBM50020819
PNG
(CHEMBL543126 | N-[2-Hydroxy-5-(2-methylamino-ethyl...)
Show SMILES CNCCc1ccc(O)c(NS(C)(=O)=O)c1
Show InChI InChI=1S/C10H16N2O3S/c1-11-6-5-8-3-4-10(13)9(7-8)12-16(2,14)15/h3-4,7,11-13H,5-6H2,1-2H3
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n/an/an/an/a 1.20E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Effective concentration (EC50) against alpha-2-adrenoceptor in the guinea pig atrium


J Med Chem 28: 245-8 (1985)


Article DOI: 10.1021/jm00380a017
BindingDB Entry DOI: 10.7270/Q2XK8G31
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50270781
PNG
(CHEMBL4129213)
Show SMILES Cl.NC(=N)Nc1nc2CCCc2s1
Show InChI InChI=1S/C7H10N4S/c8-6(9)11-7-10-4-2-1-3-5(4)12-7/h1-3H2,(H4,8,9,10,11)
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n/an/an/an/a 1.50E+3n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Activity at alpha2 adrenergic receptor in human brain prefrontal cortex membranes assessed as effect on UK14304-induced [35S]GTPgammaS binding by mea...


Eur J Med Chem 138: 38-50 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.008
BindingDB Entry DOI: 10.7270/Q2BV7K3C
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50270855
PNG
(CHEMBL4129427)
Show SMILES Cl.NC(=N)NCCc1cccs1
Show InChI InChI=1S/C7H11N3S/c8-7(9)10-4-3-6-2-1-5-11-6/h1-2,5H,3-4H2,(H4,8,9,10)
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n/an/an/an/a 1.70E+3n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Activity at alpha2 adrenergic receptor in human brain prefrontal cortex membranes assessed as effect on UK14304-induced [35S]GTPgammaS binding by mea...


Eur J Med Chem 138: 38-50 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.008
BindingDB Entry DOI: 10.7270/Q2BV7K3C
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50479675
PNG
(CHEMBL473567)
Show SMILES CCN(C)c1ccc(NC2=NCCN2)cc1
Show InChI InChI=1S/C12H18N4/c1-3-16(2)11-6-4-10(5-7-11)15-12-13-8-9-14-12/h4-7H,3,8-9H2,1-2H3,(H2,13,14,15)
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n/an/an/an/a 1.90E+3n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at alpha2 adrenoceptor in human cortical membrane after 2 hrs by [35S]GTPgammaS binding assay


J Med Chem 52: 601-9 (2009)


Article DOI: 10.1021/jm800838r
BindingDB Entry DOI: 10.7270/Q26M39MM
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-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


(Homo sapiens (Human))
BDBM50070076
PNG
(CHEMBL3407828)
Show SMILES Cl.NC(=N)Nc1ccc2CCCCc2n1
Show InChI InChI=1S/C10H14N4.ClH/c11-10(12)14-9-6-5-7-3-1-2-4-8(7)13-9;/h5-6H,1-4H2,(H4,11,12,13,14);1H
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n/an/an/an/a 2.71E+3n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Antagonist activity at human alpha-2 adrenergic receptor in brain prefrontal cortex membrane assessed as inhibition of UK14304-induced [35S]-GTPgamma...


J Med Chem 58: 963-77 (2015)


Article DOI: 10.1021/jm501635e
BindingDB Entry DOI: 10.7270/Q280549P
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50476631
PNG
(CHEMBL230861)
Show SMILES CCN(CC)c1ccc(NC2=NCCN2)cc1
Show InChI InChI=1S/C13H20N4/c1-3-17(4-2)12-7-5-11(6-8-12)16-13-14-9-10-15-13/h5-8H,3-4,9-10H2,1-2H3,(H2,14,15,16)
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n/an/an/an/a 2.76E+3n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at human brain adrenergic alpha2 receptor by [35S]GTPgammaS binding assay


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50070101
PNG
(CHEMBL3407840)
Show SMILES C1CN=C(Nc2ccc3CCCCc3n2)N1
Show InChI InChI=1S/C12H16N4/c1-2-4-10-9(3-1)5-6-11(15-10)16-12-13-7-8-14-12/h5-6H,1-4,7-8H2,(H2,13,14,15,16)
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n/an/an/an/a 3.57E+3n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Antagonist activity at human alpha-2 adrenergic receptor in brain prefrontal cortex membrane assessed as inhibition of UK14304-induced [35S]-GTPgamma...


J Med Chem 58: 963-77 (2015)


Article DOI: 10.1021/jm501635e
BindingDB Entry DOI: 10.7270/Q280549P
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50070100
PNG
(CHEMBL3408018)
Show SMILES C1CN=C(Nc2cnc3CCCCc3c2)N1
Show InChI InChI=1S/C12H16N4/c1-2-4-11-9(3-1)7-10(8-15-11)16-12-13-5-6-14-12/h7-8H,1-6H2,(H2,13,14,16)
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n/an/an/an/a 4.23E+3n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Antagonist activity at human alpha-2 adrenergic receptor in brain prefrontal cortex membrane assessed as inhibition of UK14304-induced [35S]-GTPgamma...


J Med Chem 58: 963-77 (2015)


Article DOI: 10.1021/jm501635e
BindingDB Entry DOI: 10.7270/Q280549P
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50476630
PNG
(CHEMBL242102)
Show SMILES C1CN=C(Nc2ccc(Nc3ccc(NC4=NCCN4)cc3)cc2)N1
Show InChI InChI=1S/C18H21N7/c1-5-15(24-17-19-9-10-20-17)6-2-13(1)23-14-3-7-16(8-4-14)25-18-21-11-12-22-18/h1-8,23H,9-12H2,(H2,19,20,24)(H2,21,22,25)
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n/an/an/an/a 4.38E+3n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Antagonist activity at human brain adrenergic alpha-2 receptor assessed as UK-14304-stimulated [35S]GTPgammaS binding at 10 uM


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50019059
PNG
((+/-)3-Fluoro-4-(1-hydroxy-2-methylamino-ethyl)-be...)
Show SMILES CNCC(O)c1ccc(O)c(O)c1F
Show InChI InChI=1S/C9H12FNO3/c1-11-4-7(13)5-2-3-6(12)9(14)8(5)10/h2-3,7,11-14H,4H2,1H3
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n/an/an/an/a>5.00E+3n/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Agonistic potency at alpha 2-Adrenergic receptor for inhibition of 10 uM forskolin-elicited stimulation of adenylate cyclase in human platelet membra...


J Med Chem 31: 1972-7 (1988)


Article DOI: 10.1021/jm00118a019
BindingDB Entry DOI: 10.7270/Q2V69K54
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50270854
PNG
(CHEMBL4127933)
Show SMILES Cl.NC(=N)Nc1sc2CCCCc2c1C#N
Show InChI InChI=1S/C10H12N4S/c11-5-7-6-3-1-2-4-8(6)15-9(7)14-10(12)13/h1-4H2,(H4,12,13,14)
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n/an/an/an/a 6.60E+3n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Activity at alpha2 adrenergic receptor in human brain prefrontal cortex membranes assessed as effect on UK14304-induced [35S]GTPgammaS binding by mea...


Eur J Med Chem 138: 38-50 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.008
BindingDB Entry DOI: 10.7270/Q2BV7K3C
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50070099
PNG
(CHEMBL3408019)
Show SMILES CCNc1ccc(NC2=NCCN2)cn1
Show InChI InChI=1S/C10H15N5/c1-2-11-9-4-3-8(7-14-9)15-10-12-5-6-13-10/h3-4,7H,2,5-6H2,1H3,(H,11,14)(H2,12,13,15)
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n/an/an/an/a 6.71E+3n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Antagonist activity at human alpha-2 adrenergic receptor in brain prefrontal cortex membrane assessed as inhibition of UK14304-induced [35S]-GTPgamma...


J Med Chem 58: 963-77 (2015)


Article DOI: 10.1021/jm501635e
BindingDB Entry DOI: 10.7270/Q280549P
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-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


(Homo sapiens (Human))
BDBM50270851
PNG
(CHEMBL4127137)
Show SMILES Cl.NC(=N)Nc1cc2CCCCCc2s1
Show InChI InChI=1S/C10H15N3S/c11-10(12)13-9-6-7-4-2-1-3-5-8(7)14-9/h6H,1-5H2,(H4,11,12,13)
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n/an/an/an/a 1.07E+4n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Activity at alpha2 adrenergic receptor in human brain prefrontal cortex membranes assessed as effect on UK14304-induced [35S]GTPgammaS binding by mea...


Eur J Med Chem 138: 38-50 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.008
BindingDB Entry DOI: 10.7270/Q2BV7K3C
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM34572
PNG
(BRIMONIDINE | CHEMBL844 | MLS000069370 | SMR000058...)
Show SMILES Brc1c(NC2=NCCN2)ccc2nccnc12
Show InChI InChI=1S/C11H10BrN5/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8/h1-4H,5-6H2,(H2,15,16,17)
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n/an/an/an/a 1.14E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at human brain adrenergic alpha2 receptor by [35S]GTPgammaS binding assay


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50270780
PNG
(CHEMBL4125903)
Show SMILES Cl.NC(=N)Nc1nc2CCCCc2s1
Show InChI InChI=1S/C8H12N4S/c9-7(10)12-8-11-5-3-1-2-4-6(5)13-8/h1-4H2,(H4,9,10,11,12)
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n/an/an/an/a 1.14E+4n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Activity at alpha2 adrenergic receptor in human brain prefrontal cortex membranes assessed as effect on UK14304-induced [35S]GTPgammaS binding by mea...


Eur J Med Chem 138: 38-50 (2017)


Article DOI: 10.1016/j.ejmech.2017.06.008
BindingDB Entry DOI: 10.7270/Q2BV7K3C
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM34572
PNG
(BRIMONIDINE | CHEMBL844 | MLS000069370 | SMR000058...)
Show SMILES Brc1c(NC2=NCCN2)ccc2nccnc12
Show InChI InChI=1S/C11H10BrN5/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8/h1-4H,5-6H2,(H2,15,16,17)
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n/an/an/an/a 1.14E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at alpha2 adrenoceptor in human cortical membrane after 2 hrs by [35S]GTPgammaS binding assay


J Med Chem 52: 601-9 (2009)


Article DOI: 10.1021/jm800838r
BindingDB Entry DOI: 10.7270/Q26M39MM
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50476636
PNG
(4-Guanidinoaniline Dihydrochloride Salt | CHEMBL12...)
Show SMILES Cl.Cl.CN(C)c1ccc(NC(N)=N)cc1
Show InChI InChI=1S/C9H14N4/c1-13(2)8-5-3-7(4-6-8)12-9(10)11/h3-6H,1-2H3,(H4,10,11,12)
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n/an/an/an/a 1.60E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Antagonist activity at human brain adrenergic alpha-2 receptor assessed as UK-14304-stimulated [35S]GTPgammaS binding at 10 uM


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50479674
PNG
(CHEMBL482359)
Show SMILES CCN(C)c1ccc(NC(N)=N)cc1
Show InChI InChI=1S/C10H16N4/c1-3-14(2)9-6-4-8(5-7-9)13-10(11)12/h4-7H,3H2,1-2H3,(H4,11,12,13)
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n/an/an/an/a 1.62E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at alpha2 adrenoceptor in human cortical membrane after 2 hrs by [35S]GTPgammaS binding assay


J Med Chem 52: 601-9 (2009)


Article DOI: 10.1021/jm800838r
BindingDB Entry DOI: 10.7270/Q26M39MM
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50476635
PNG
(CHEMBL230644)
Show SMILES COc1ccc(NC2=NCCN2)cc1
Show InChI InChI=1S/C10H13N3O/c1-14-9-4-2-8(3-5-9)13-10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H2,11,12,13)
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n/an/an/an/a 3.04E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at human brain adrenergic alpha2 receptor by [35S]GTPgammaS binding assay


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50070098
PNG
(CHEMBL3408028)
Show SMILES N=C(NCc1ccco1)Nc1ccc2CCCCc2n1
Show InChI InChI=1S/C15H18N4O/c16-15(17-10-12-5-3-9-20-12)19-14-8-7-11-4-1-2-6-13(11)18-14/h3,5,7-9H,1-2,4,6,10H2,(H3,16,17,18,19)
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n/an/an/an/a 3.70E+4n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Antagonist activity at human alpha-2 adrenergic receptor in brain prefrontal cortex membrane assessed as inhibition of UK14304-induced [35S]-GTPgamma...


J Med Chem 58: 963-77 (2015)


Article DOI: 10.1021/jm501635e
BindingDB Entry DOI: 10.7270/Q280549P
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50479677
PNG
(CHEMBL482200)
Show SMILES CCC(CC)c1ccc(NC(N)=N)cc1
Show InChI InChI=1S/C12H19N3/c1-3-9(4-2)10-5-7-11(8-6-10)15-12(13)14/h5-9H,3-4H2,1-2H3,(H4,13,14,15)
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n/an/an/an/a 3.87E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at alpha2 adrenoceptor in human cortical membrane after 2 hrs by [35S]GTPgammaS binding assay


J Med Chem 52: 601-9 (2009)


Article DOI: 10.1021/jm800838r
BindingDB Entry DOI: 10.7270/Q26M39MM
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50476646
PNG
(CHEMBL242839)
Show SMILES NC(=N)Nc1ccc2OCCOc2c1
Show InChI InChI=1S/C9H11N3O2/c10-9(11)12-6-1-2-7-8(5-6)14-4-3-13-7/h1-2,5H,3-4H2,(H4,10,11,12)
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n/an/an/an/a 4.22E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at human brain adrenergic alpha2 receptor by [35S]GTPgammaS binding assay


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50223870
PNG
(CHEMBL9441)
Show SMILES CSc1ccc(NC2=NCCN2)cc1
Show InChI InChI=1S/C10H13N3S/c1-14-9-4-2-8(3-5-9)13-10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H2,11,12,13)
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n/an/an/an/a 4.53E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at human brain adrenergic alpha2 receptor by [35S]GTPgammaS binding assay


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50213214
PNG
(CHEMBL42139)
Show SMILES C1CN=C(Nc2ccc3OCCOc3c2)N1
Show InChI InChI=1S/C11H13N3O2/c1-2-9-10(16-6-5-15-9)7-8(1)14-11-12-3-4-13-11/h1-2,7H,3-6H2,(H2,12,13,14)
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n/an/an/an/a 5.64E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at human brain adrenergic alpha2 receptor by [35S]GTPgammaS binding assay


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50479679
PNG
(CHEMBL506313)
Show SMILES CCNc1ccc(NC2=NCCN2)cc1
Show InChI InChI=1S/C11H16N4/c1-2-12-9-3-5-10(6-4-9)15-11-13-7-8-14-11/h3-6,12H,2,7-8H2,1H3,(H2,13,14,15)
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n/an/an/an/a 5.93E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at alpha2 adrenoceptor in human cortical membrane after 2 hrs by [35S]GTPgammaS binding assay


J Med Chem 52: 601-9 (2009)


Article DOI: 10.1021/jm800838r
BindingDB Entry DOI: 10.7270/Q26M39MM
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50070081
PNG
(CHEMBL3408032)
Show SMILES OCCNC1=NCc2ccccc2N1
Show InChI InChI=1S/C10H13N3O/c14-6-5-11-10-12-7-8-3-1-2-4-9(8)13-10/h1-4,14H,5-7H2,(H2,11,12,13)
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Article
PubMed
n/an/an/an/a 6.03E+4n/an/an/an/a



Trinity College

Curated by ChEMBL


Assay Description
Antagonist activity at human alpha-2 adrenergic receptor in brain prefrontal cortex membrane assessed as inhibition of UK14304-induced [35S]-GTPgamma...


J Med Chem 58: 963-77 (2015)


Article DOI: 10.1021/jm501635e
BindingDB Entry DOI: 10.7270/Q280549P
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50479673
PNG
(CHEMBL467525)
Show SMILES CNc1ccc(NC2=NCCN2)cc1
Show InChI InChI=1S/C10H14N4/c1-11-8-2-4-9(5-3-8)14-10-12-6-7-13-10/h2-5,11H,6-7H2,1H3,(H2,12,13,14)
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n/an/an/an/a 6.14E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at alpha2 adrenoceptor in human cortical membrane after 2 hrs by [35S]GTPgammaS binding assay


J Med Chem 52: 601-9 (2009)


Article DOI: 10.1021/jm800838r
BindingDB Entry DOI: 10.7270/Q26M39MM
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50479676
PNG
(CHEMBL509581)
Show SMILES CNc1ccc(NC(N)=N)cc1
Show InChI InChI=1S/C8H12N4/c1-11-6-2-4-7(5-3-6)12-8(9)10/h2-5,11H,1H3,(H4,9,10,12)
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n/an/an/an/a 8.23E+4n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at alpha2 adrenoceptor in human cortical membrane after 2 hrs by [35S]GTPgammaS binding assay


J Med Chem 52: 601-9 (2009)


Article DOI: 10.1021/jm800838r
BindingDB Entry DOI: 10.7270/Q26M39MM
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50476629
PNG
(4,4''-Di(2-Imidazolidinylimino)Diphenyl Ether | CH...)
Show SMILES C1CN=C(Nc2ccc(Oc3ccc(NC4=NCCN4)cc3)cc2)N1
Show InChI InChI=1S/C18H20N6O/c1-5-15(6-2-13(1)23-17-19-9-10-20-17)25-16-7-3-14(4-8-16)24-18-21-11-12-22-18/h1-8H,9-12H2,(H2,19,20,23)(H2,21,22,24)
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n/an/an/an/a 1.20E+5n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at human brain adrenergic alpha2 receptor by [35S]GTPgammaS binding assay


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50476639
PNG
(CHEMBL243061)
Show SMILES C1CN=C(Nc2ccc3OCOc3c2)N1
Show InChI InChI=1S/C10H11N3O2/c1-2-8-9(15-6-14-8)5-7(1)13-10-11-3-4-12-10/h1-2,5H,3-4,6H2,(H2,11,12,13)
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n/an/an/an/a 1.41E+5n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Antagonist activity at human brain adrenergic alpha-2 receptor assessed as UK-14304-stimulated [35S]GTPgammaS binding at 10 uM


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
Adrenergic receptor alpha-2


(Homo sapiens (Human))
BDBM50476634
PNG
(4,4''-Di(2-Imidazolidinylimino)Diphenyl Sulfide | ...)
Show SMILES C1CN=C(Nc2ccc(Sc3ccc(NC4=NCCN4)cc3)cc2)N1
Show InChI InChI=1S/C18H20N6S/c1-5-15(6-2-13(1)23-17-19-9-10-20-17)25-16-7-3-14(4-8-16)24-18-21-11-12-22-18/h1-8H,9-12H2,(H2,19,20,23)(H2,21,22,24)
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n/an/an/an/a 3.32E+5n/an/an/an/a



University of Dublin

Curated by ChEMBL


Assay Description
Agonist activity at human brain adrenergic alpha2 receptor by [35S]GTPgammaS binding assay


J Med Chem 50: 4516-27 (2007)


Article DOI: 10.1021/jm070229q
BindingDB Entry DOI: 10.7270/Q2571FSN
More data for this
Ligand-Target Pair
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