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Compile Data Set for Download or QSAR

Found 53 hits with Last Name = 'ferdousi' and Initial = 'm'   
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-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50271255
PNG
(1-[(Imidazolidin-2-yl)imino]indazole hydrochloride...)
Show SMILES [#6]-1-[#6]-[#7]\[#6](-[#7]-1)=[#7]/n1ncc2ccccc12
Show InChI InChI=1S/C10H11N5/c1-2-4-9-8(3-1)7-13-15(9)14-10-11-5-6-12-10/h1-4,7H,5-6H2,(H2,11,12,14)
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14n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RX821002 from alpha2-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50497435
PNG
(CHEMBL3343699)
Show SMILES Fc1ccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c2c1
Show InChI InChI=1S/C10H10FN5/c11-8-2-1-7-6-14-16(9(7)5-8)15-10-12-3-4-13-10/h1-2,5-6H,3-4H2,(H2,12,13,15)
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26n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RX821002 from alpha2-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50497438
PNG
(CHEMBL3343704)
Show SMILES Fc1ccc2cnn(CC3=NCCN3)c2c1 |t:9|
Show InChI InChI=1S/C11H11FN4/c12-9-2-1-8-6-15-16(10(8)5-9)7-11-13-3-4-14-11/h1-2,5-6H,3-4,7H2,(H,13,14)
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30n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RX821002 from alpha2-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50497439
PNG
(CHEMBL3343700)
Show SMILES Fc1cccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c12
Show InChI InChI=1S/C10H10FN5/c11-8-3-1-2-7-6-14-16(9(7)8)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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31n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RX821002 from alpha2-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164835
PNG
(CHEMBL3800398)
Show SMILES Cl.Fc1ccc2n(CC3=NCCN3)ccc2c1 |t:7|
Show InChI InChI=1S/C12H12FN3.ClH/c13-10-1-2-11-9(7-10)3-6-16(11)8-12-14-4-5-15-12;/h1-3,6-7H,4-5,8H2,(H,14,15);1H
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32n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50497436
PNG
(CHEMBL3343703)
Show SMILES Fc1ccc2n(CC3=NCCN3)ncc2c1 |t:7|
Show InChI InChI=1S/C11H11FN4/c12-9-1-2-10-8(5-9)6-15-16(10)7-11-13-3-4-14-11/h1-2,5-6H,3-4,7H2,(H,13,14)
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32n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RX821002 from alpha2-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor


(Homo sapiens (Human))
BDBM50497435
PNG
(CHEMBL3343699)
Show SMILES Fc1ccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c2c1
Show InChI InChI=1S/C10H10FN5/c11-8-2-1-7-6-14-16(9(7)5-8)15-10-12-3-4-13-10/h1-2,5-6H,3-4H2,(H2,12,13,15)
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33n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RS-79948-197 from human alpha2A adrenoceptor expressed in CHO-K1 cells after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor


(Homo sapiens (Human))
BDBM50271255
PNG
(1-[(Imidazolidin-2-yl)imino]indazole hydrochloride...)
Show SMILES [#6]-1-[#6]-[#7]\[#6](-[#7]-1)=[#7]/n1ncc2ccccc12
Show InChI InChI=1S/C10H11N5/c1-2-4-9-8(3-1)7-13-15(9)14-10-11-5-6-12-10/h1-4,7H,5-6H2,(H2,11,12,14)
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52n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RS-79948-197 from human alpha2A adrenoceptor expressed in CHO-K1 cells after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50497440
PNG
(CHEMBL3343698)
Show SMILES Fc1ccc2n(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)ncc2c1
Show InChI InChI=1S/C10H10FN5/c11-8-1-2-9-7(5-8)6-14-16(9)15-10-12-3-4-13-10/h1-2,5-6H,3-4H2,(H2,12,13,15)
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64n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RX821002 from alpha2-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor


(Homo sapiens (Human))
BDBM50497439
PNG
(CHEMBL3343700)
Show SMILES Fc1cccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c12
Show InChI InChI=1S/C10H10FN5/c11-8-3-1-2-7-6-14-16(9(7)8)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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65n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RS-79948-197 from human alpha2A adrenoceptor expressed in CHO-K1 cells after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2B adrenergic receptor


(Homo sapiens (Human))
BDBM50497435
PNG
(CHEMBL3343699)
Show SMILES Fc1ccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c2c1
Show InChI InChI=1S/C10H10FN5/c11-8-2-1-7-6-14-16(9(7)5-8)15-10-12-3-4-13-10/h1-2,5-6H,3-4H2,(H2,12,13,15)
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72n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RS-79948-197 from human alpha2B adrenoceptor expressed in CHO-K1 cells after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164841
PNG
(CHEMBL3798191)
Show SMILES Cl.Brc1cccc2ccn(CC3=NCCN3)c12 |t:10|
Show InChI InChI=1S/C12H12BrN3.ClH/c13-10-3-1-2-9-4-7-16(12(9)10)8-11-14-5-6-15-11;/h1-4,7H,5-6,8H2,(H,14,15);1H
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79n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Alpha-2B adrenergic receptor


(Homo sapiens (Human))
BDBM50271255
PNG
(1-[(Imidazolidin-2-yl)imino]indazole hydrochloride...)
Show SMILES [#6]-1-[#6]-[#7]\[#6](-[#7]-1)=[#7]/n1ncc2ccccc12
Show InChI InChI=1S/C10H11N5/c1-2-4-9-8(3-1)7-13-15(9)14-10-11-5-6-12-10/h1-4,7H,5-6H2,(H2,11,12,14)
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79n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RS-79948-197 from human alpha2B adrenoceptor expressed in CHO-K1 cells after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2B adrenergic receptor


(Homo sapiens (Human))
BDBM50497439
PNG
(CHEMBL3343700)
Show SMILES Fc1cccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c12
Show InChI InChI=1S/C10H10FN5/c11-8-3-1-2-7-6-14-16(9(7)8)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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158n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RS-79948-197 from human alpha2B adrenoceptor expressed in CHO-K1 cells after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50497433
PNG
(CHEMBL3343702)
Show SMILES Fc1cccc2n(CC3=NCCN3)ncc12 |t:8|
Show InChI InChI=1S/C11H11FN4/c12-9-2-1-3-10-8(9)6-15-16(10)7-11-13-4-5-14-11/h1-3,6H,4-5,7H2,(H,13,14)
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187n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RX821002 from alpha2-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50497434
PNG
(CHEMBL3343697)
Show SMILES Fc1cccc2n(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)ncc12
Show InChI InChI=1S/C10H10FN5/c11-8-2-1-3-9-7(8)6-14-16(9)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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416n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RX821002 from alpha2-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164834
PNG
(CHEMBL3798638)
Show SMILES Cl.Brc1cccc2n(CC3=NCCN3)ccc12 |t:8|
Show InChI InChI=1S/C12H12BrN3.ClH/c13-10-2-1-3-11-9(10)4-7-16(11)8-12-14-5-6-15-12;/h1-4,7H,5-6,8H2,(H,14,15);1H
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468n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50497436
PNG
(CHEMBL3343703)
Show SMILES Fc1ccc2n(CC3=NCCN3)ncc2c1 |t:7|
Show InChI InChI=1S/C11H11FN4/c12-9-1-2-10-8(5-9)6-15-16(10)7-11-13-3-4-14-11/h1-2,5-6H,3-4,7H2,(H,13,14)
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476n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from alpha1-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50497438
PNG
(CHEMBL3343704)
Show SMILES Fc1ccc2cnn(CC3=NCCN3)c2c1 |t:9|
Show InChI InChI=1S/C11H11FN4/c12-9-2-1-8-6-15-16(10(8)5-9)7-11-13-3-4-14-11/h1-2,5-6H,3-4,7H2,(H,13,14)
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518n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from alpha1-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50497433
PNG
(CHEMBL3343702)
Show SMILES Fc1cccc2n(CC3=NCCN3)ncc12 |t:8|
Show InChI InChI=1S/C11H11FN4/c12-9-2-1-3-10-8(9)6-15-16(10)7-11-13-4-5-14-11/h1-3,6H,4-5,7H2,(H,13,14)
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535n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from alpha1-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2C adrenergic receptor


(Homo sapiens (Human))
BDBM50497435
PNG
(CHEMBL3343699)
Show SMILES Fc1ccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c2c1
Show InChI InChI=1S/C10H10FN5/c11-8-2-1-7-6-14-16(9(7)5-8)15-10-12-3-4-13-10/h1-2,5-6H,3-4H2,(H2,12,13,15)
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600n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RS-79948-197 from human alpha2C adrenoceptor expressed in CHO-K1 cells after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2C adrenergic receptor


(Homo sapiens (Human))
BDBM50271255
PNG
(1-[(Imidazolidin-2-yl)imino]indazole hydrochloride...)
Show SMILES [#6]-1-[#6]-[#7]\[#6](-[#7]-1)=[#7]/n1ncc2ccccc12
Show InChI InChI=1S/C10H11N5/c1-2-4-9-8(3-1)7-13-15(9)14-10-11-5-6-12-10/h1-4,7H,5-6H2,(H2,11,12,14)
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640n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RS-79948-197 from human alpha2C adrenoceptor expressed in CHO-K1 cells after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164837
PNG
(CHEMBL3800446)
Show SMILES Cl.Fc1ccc2ccn(CC3=NCCN3)c2c1 |t:9|
Show InChI InChI=1S/C12H12FN3.ClH/c13-10-2-1-9-3-6-16(11(9)7-10)8-12-14-4-5-15-12;/h1-3,6-7H,4-5,8H2,(H,14,15);1H
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789n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50497435
PNG
(CHEMBL3343699)
Show SMILES Fc1ccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c2c1
Show InChI InChI=1S/C10H10FN5/c11-8-2-1-7-6-14-16(9(7)5-8)15-10-12-3-4-13-10/h1-2,5-6H,3-4H2,(H2,12,13,15)
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918n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from alpha1-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164842
PNG
(CHEMBL3798387)
Show SMILES Br.Cc1cccc2ccn(CC3=NCCN3)c12 |t:10|
Show InChI InChI=1S/C13H15N3.BrH/c1-10-3-2-4-11-5-8-16(13(10)11)9-12-14-6-7-15-12;/h2-5,8H,6-7,9H2,1H3,(H,14,15);1H
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1.00E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Alpha-2C adrenergic receptor


(Homo sapiens (Human))
BDBM50497439
PNG
(CHEMBL3343700)
Show SMILES Fc1cccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c12
Show InChI InChI=1S/C10H10FN5/c11-8-3-1-2-7-6-14-16(9(7)8)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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1.20E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RS-79948-197 from human alpha2C adrenoceptor expressed in CHO-K1 cells after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50497439
PNG
(CHEMBL3343700)
Show SMILES Fc1cccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c12
Show InChI InChI=1S/C10H10FN5/c11-8-3-1-2-7-6-14-16(9(7)8)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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1.63E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from alpha1-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50497440
PNG
(CHEMBL3343698)
Show SMILES Fc1ccc2n(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)ncc2c1
Show InChI InChI=1S/C10H10FN5/c11-8-1-2-9-7(5-8)6-14-16(9)15-10-12-3-4-13-10/h1-2,5-6H,3-4H2,(H2,12,13,15)
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2.32E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from alpha1-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50497437
PNG
(CHEMBL3343701)
Show SMILES Fc1c(F)c(F)c2n(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)ncc2c1F
Show InChI InChI=1S/C10H7F4N5/c11-5-4-3-17-19(18-10-15-1-2-16-10)9(4)8(14)7(13)6(5)12/h3H,1-2H2,(H2,15,16,18)
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3.72E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]RX821002 from alpha2-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50497434
PNG
(CHEMBL3343697)
Show SMILES Fc1cccc2n(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)ncc12
Show InChI InChI=1S/C10H10FN5/c11-8-2-1-3-9-7(8)6-14-16(9)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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3.81E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from alpha1-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164838
PNG
(CHEMBL3797854)
Show SMILES Cl.Clc1ccc2ccn(CC3=NCCN3)c2c1 |t:9|
Show InChI InChI=1S/C12H12ClN3.ClH/c13-10-2-1-9-3-6-16(11(9)7-10)8-12-14-4-5-15-12;/h1-3,6-7H,4-5,8H2,(H,14,15);1H
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5.58E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164839
PNG
(CHEMBL3797661)
Show SMILES Cl.Fc1cccc2ccn(CC3=NCCN3)c12 |t:10|
Show InChI InChI=1S/C12H12FN3.ClH/c13-10-3-1-2-9-4-7-16(12(9)10)8-11-14-5-6-15-11;/h1-4,7H,5-6,8H2,(H,14,15);1H
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9.63E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164840
PNG
(CHEMBL3799780)
Show SMILES Cl.Clc1cccc2ccn(CC3=NCCN3)c12 |t:10|
Show InChI InChI=1S/C12H12ClN3.ClH/c13-10-3-1-2-9-4-7-16(12(9)10)8-11-14-5-6-15-11;/h1-4,7H,5-6,8H2,(H,14,15);1H
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1.03E+4n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164836
PNG
(CHEMBL3798967)
Show SMILES Cl.Brc1ccc2n(CC3=NCCN3)ccc2c1 |t:7|
Show InChI InChI=1S/C12H12BrN3.ClH/c13-10-1-2-11-9(7-10)3-6-16(11)8-12-14-4-5-15-12;/h1-3,6-7H,4-5,8H2,(H,14,15);1H
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1.05E+4n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164833
PNG
(CHEMBL3799346)
Show SMILES Cl.Fc1cccc2n(CC3=NCCN3)ccc12 |t:8|
Show InChI InChI=1S/C12H12FN3.ClH/c13-10-2-1-3-11-9(10)4-7-16(11)8-12-14-5-6-15-12;/h1-4,7H,5-6,8H2,(H,14,15);1H
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1.46E+4n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Alpha-1A/Alpha-1B/Alpha-1D adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50497437
PNG
(CHEMBL3343701)
Show SMILES Fc1c(F)c(F)c2n(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)ncc2c1F
Show InChI InChI=1S/C10H7F4N5/c11-5-4-3-17-19(18-10-15-1-2-16-10)9(4)8(14)7(13)6(5)12/h3H,1-2H2,(H2,15,16,18)
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1.98E+4n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from alpha1-adrenoceptor in Sprague-Dawley rat brain membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164845
PNG
(CHEMBL3799081)
Show SMILES Br.C(Oc1cccc2ccn(CC3=NCCN3)c12)c1ccccc1 |t:11|
Show InChI InChI=1S/C19H19N3O.BrH/c1-2-5-15(6-3-1)14-23-17-8-4-7-16-9-12-22(19(16)17)13-18-20-10-11-21-18;/h1-9,12H,10-11,13-14H2,(H,20,21);1H
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3.63E+4n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164843
PNG
(CHEMBL3800486)
Show SMILES Cl.CCc1cccc2ccn(CC3=NCCN3)c12 |t:11|
Show InChI InChI=1S/C14H17N3.ClH/c1-2-11-4-3-5-12-6-9-17(14(11)12)10-13-15-7-8-16-13;/h3-6,9H,2,7-8,10H2,1H3,(H,15,16);1H
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4.58E+4n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164832
PNG
(CHEMBL3797481)
Show SMILES Cl.C(C1=NCCN1)n1ccc2ccccc12 |t:1|
Show InChI InChI=1S/C12H13N3.ClH/c1-2-4-11-10(3-1)5-8-15(11)9-12-13-6-7-14-12;/h1-5,8H,6-7,9H2,(H,13,14);1H
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8.14E+4n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50164844
PNG
(CHEMBL3798276)
Show SMILES Br.COc1cccc2ccn(CC3=NCCN3)c12 |t:11|
Show InChI InChI=1S/C13H15N3O.BrH/c1-17-11-4-2-3-10-5-8-16(13(10)11)9-12-14-6-7-15-12;/h2-5,8H,6-7,9H2,1H3,(H,14,15);1H
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5.88E+5n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]clonidine from Imidazoline receptor 1 in Sprague-Dawley rat kidney P2 membranes after 45 hrs by liquid scintillation counting


Eur J Med Chem 115: 406-15 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.026
BindingDB Entry DOI: 10.7270/Q2GH9KVS
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50497440
PNG
(CHEMBL3343698)
Show SMILES Fc1ccc2n(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)ncc2c1
Show InChI InChI=1S/C10H10FN5/c11-8-1-2-9-7(5-8)6-14-16(9)15-10-12-3-4-13-10/h1-2,5-6H,3-4H2,(H2,12,13,15)
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n/an/a 92n/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]2BF1 from imidazoline I1 receptor in Sprague-Dawley rat kidney membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50497433
PNG
(CHEMBL3343702)
Show SMILES Fc1cccc2n(CC3=NCCN3)ncc12 |t:8|
Show InChI InChI=1S/C11H11FN4/c12-9-2-1-3-10-8(9)6-15-16(10)7-11-13-4-5-14-11/h1-3,6H,4-5,7H2,(H,13,14)
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n/an/a 1.77E+3n/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]2BF1 from imidazoline I1 receptor in Sprague-Dawley rat kidney membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50497436
PNG
(CHEMBL3343703)
Show SMILES Fc1ccc2n(CC3=NCCN3)ncc2c1 |t:7|
Show InChI InChI=1S/C11H11FN4/c12-9-1-2-10-8(5-9)6-15-16(10)7-11-13-3-4-14-11/h1-2,5-6H,3-4,7H2,(H,13,14)
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n/an/a 2.42E+3n/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]2BF1 from imidazoline I1 receptor in Sprague-Dawley rat kidney membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50497437
PNG
(CHEMBL3343701)
Show SMILES Fc1c(F)c(F)c2n(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)ncc2c1F
Show InChI InChI=1S/C10H7F4N5/c11-5-4-3-17-19(18-10-15-1-2-16-10)9(4)8(14)7(13)6(5)12/h3H,1-2H2,(H2,15,16,18)
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n/an/a 5.83E+3n/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]2BF1 from imidazoline I1 receptor in Sprague-Dawley rat kidney membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50497439
PNG
(CHEMBL3343700)
Show SMILES Fc1cccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c12
Show InChI InChI=1S/C10H10FN5/c11-8-3-1-2-7-6-14-16(9(7)8)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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n/an/a 7.74E+3n/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]2BF1 from imidazoline I1 receptor in Sprague-Dawley rat kidney membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50497434
PNG
(CHEMBL3343697)
Show SMILES Fc1cccc2n(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)ncc12
Show InChI InChI=1S/C10H10FN5/c11-8-2-1-3-9-7(8)6-14-16(9)15-10-12-4-5-13-10/h1-3,6H,4-5H2,(H2,12,13,15)
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n/an/a 1.48E+4n/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]2BF1 from imidazoline I1 receptor in Sprague-Dawley rat kidney membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50497435
PNG
(CHEMBL3343699)
Show SMILES Fc1ccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c2c1
Show InChI InChI=1S/C10H10FN5/c11-8-2-1-7-6-14-16(9(7)5-8)15-10-12-3-4-13-10/h1-2,5-6H,3-4H2,(H2,12,13,15)
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n/an/a 2.07E+4n/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]2BF1 from imidazoline I1 receptor in Sprague-Dawley rat kidney membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50497438
PNG
(CHEMBL3343704)
Show SMILES Fc1ccc2cnn(CC3=NCCN3)c2c1 |t:9|
Show InChI InChI=1S/C11H11FN4/c12-9-2-1-8-6-15-16(10(8)5-9)7-11-13-3-4-14-11/h1-2,5-6H,3-4,7H2,(H,13,14)
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n/an/a 3.35E+4n/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]2BF1 from imidazoline I1 receptor in Sprague-Dawley rat kidney membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Nischarin


(RAT)
BDBM50271255
PNG
(1-[(Imidazolidin-2-yl)imino]indazole hydrochloride...)
Show SMILES [#6]-1-[#6]-[#7]\[#6](-[#7]-1)=[#7]/n1ncc2ccccc12
Show InChI InChI=1S/C10H11N5/c1-2-4-9-8(3-1)7-13-15(9)14-10-11-5-6-12-10/h1-4,7H,5-6H2,(H2,11,12,14)
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Similars

Article
PubMed
n/an/a 5.46E+4n/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Displacement of [3H]2BF1 from imidazoline I1 receptor in Sprague-Dawley rat kidney membranes after 45 mins by liquid scintillation counting


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor


(Homo sapiens (Human))
BDBM50497435
PNG
(CHEMBL3343699)
Show SMILES Fc1ccc2cnn(\[#7]=[#6]-3\[#7]-[#6]-[#6]-[#7]-3)c2c1
Show InChI InChI=1S/C10H10FN5/c11-8-2-1-7-6-14-16(9(7)5-8)15-10-12-3-4-13-10/h1-2,5-6H,3-4H2,(H2,12,13,15)
PDB

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antibodypedia
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n/an/an/an/a 39n/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Agonist activity at human alpha2A adrenoceptor expressed in CHO-K1 cells after 30 mins by [35S]GTPgammaS binding assay


Eur J Med Chem 87: 386-97 (2014)


Article DOI: 10.1016/j.ejmech.2014.09.083
BindingDB Entry DOI: 10.7270/Q2MW2M45
More data for this
Ligand-Target Pair
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