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Compile Data Set for Download or QSAR

Found 100 hits Enz. Inhib. hit(s) with Target = 'Nischarin' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Nischarin


(Homo sapiens)
BDBM50127591
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4,6-dimethyl-3,4-...)
Show SMILES CN1CC(Oc2ccc(C)cc12)C1=NCCN1
Show InChI InChI=1S/C13H17N3O/c1-9-3-4-11-10(7-9)16(2)8-12(17-11)13-14-5-6-15-13/h3-4,7,12H,5-6,8H2,1-2H3,(H,14,15)
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2n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-2 using rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127590
PNG
(4-(4,5-Dihydro-1H-imidazol-2-yl)-3,4-dihydro-5-oxa...)
Show SMILES C1CN=C(N1)C1Cn2ccc3cccc(O1)c23
Show InChI InChI=1S/C13H13N3O/c1-2-9-4-7-16-8-11(13-14-5-6-15-13)17-10(3-1)12(9)16/h1-4,7,11H,5-6,8H2,(H,14,15)
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3.5n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50050093
PNG
((4-Chloro-6-methoxy-2-methyl-pyrimidin-5-yl)-imida...)
Show SMILES COc1nc(C)nc(Cl)c1N=C1NCCN1
Show InChI InChI=1S/C9H12ClN5O/c1-5-13-7(10)6(8(14-5)16-2)15-9-11-3-4-12-9/h3-4H2,1-2H3,(H2,11,12,15)
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4.20n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50021809
PNG
((2,6-Dichloro-4-iodo-phenyl)-(4,5-dihydro-1H-imida...)
Show SMILES Clc1cc(I)cc(Cl)c1N=C1NCCN1
Show InChI InChI=1S/C9H8Cl2IN3/c10-6-3-5(12)4-7(11)8(6)15-9-13-1-2-14-9/h3-4H,1-2H2,(H2,13,14,15)
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4.80n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50412317
PNG
(CHEMBL468161)
Show SMILES CC1CCC(Nc2cc(N[N+]#N)c(I)cc2Cl)=N1
Show InChI InChI=1S/C11H12ClIN5/c1-6-2-3-11(15-6)16-9-5-10(17-18-14)8(13)4-7(9)12/h4-6,17H,2-3H2,1H3,(H,15,16)/q+1
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6.03n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 expressed in rat PC12 cells


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM30712
PNG
(6-tert-butyl-3-(2-imidazolin-2-ylmethyl)-2,4-dimet...)
Show SMILES Cc1cc(c(O)c(C)c1CC1=NCCN1)C(C)(C)C
Show InChI InChI=1S/C16H24N2O/c1-10-8-13(16(3,4)5)15(19)11(2)12(10)9-14-17-6-7-18-14/h8,19H,6-7,9H2,1-5H3,(H,17,18)
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6.20n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127595
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4-methyl-3,4-dihy...)
Show SMILES COC(=O)c1ccc2OC(CN(C)c2c1)C1=NCCN1
Show InChI InChI=1S/C14H17N3O3/c1-17-8-12(13-15-5-6-16-13)20-11-4-3-9(7-10(11)17)14(18)19-2/h3-4,7,12H,5-6,8H2,1-2H3,(H,15,16)
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7n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-2 using rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127575
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4-methyl-3,4-dihy...)
Show SMILES CN1CC(Oc2ccccc12)C1=NCCN1
Show InChI InChI=1S/C12H15N3O/c1-15-8-11(12-13-6-7-14-12)16-10-5-3-2-4-9(10)15/h2-5,11H,6-8H2,1H3,(H,13,14)
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8n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50016897
PNG
(2-(2,6-dichloroanilino)-1,3-diazacyclopentene-(2) ...)
Show SMILES Clc1cccc(Cl)c1N=C1NCCN1
Show InChI InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)
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8.90n/an/an/an/an/an/an/an/a



Allergan Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of [3H]-clonidine from bovine imidazoline receptor I-1


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50138500
PNG
(2-((E)-Styryl)-4,5-dihydro-1H-imidazole | 2-styryl...)
Show SMILES C1CN=C(N1)\C=C\c1ccccc1
Show InChI InChI=1S/C11H12N2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h1-7H,8-9H2,(H,12,13)/b7-6+
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10n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity for rat imidazoline receptor I-1 from crude P2 membranes


Bioorg Med Chem Lett 14: 527-9 (2003)

More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127600
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-2,3,5,6-tetrahydr...)
Show SMILES C1CN=C(N1)C1CN2CCCc3cccc(O1)c23
Show InChI InChI=1S/C14H17N3O/c1-3-10-4-2-8-17-9-12(14-15-6-7-16-14)18-11(5-1)13(10)17/h1,3,5,12H,2,4,6-9H2,(H,15,16)
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10n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-2 using rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
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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11.4n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50132097
PNG
(7-Methoxy-2,3,4,9-tetrahydro-1H-beta-carboline | C...)
Show SMILES COc1ccc2c3CCNCc3[nH]c2c1
Show InChI InChI=1S/C12H14N2O/c1-15-8-2-3-9-10-4-5-13-7-12(10)14-11(9)6-8/h2-3,6,13-14H,4-5,7H2,1H3
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12n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards Imidazoline I2 receptor


Bioorg Med Chem Lett 13: 4421-5 (2003)

More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127590
PNG
(4-(4,5-Dihydro-1H-imidazol-2-yl)-3,4-dihydro-5-oxa...)
Show SMILES C1CN=C(N1)C1Cn2ccc3cccc(O1)c23
Show InChI InChI=1S/C13H13N3O/c1-2-9-4-7-16-8-11(13-14-5-6-15-13)17-10(3-1)12(9)16/h1-4,7,11H,5-6,8H2,(H,14,15)
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13n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127573
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-6-ethoxymethyl-4-...)
Show SMILES CCOCc1ccc2OC(CN(C)c2c1)C1=NCCN1
Show InChI InChI=1S/C15H21N3O2/c1-3-19-10-11-4-5-13-12(8-11)18(2)9-14(20-13)15-16-6-7-17-15/h4-5,8,14H,3,6-7,9-10H2,1-2H3,(H,16,17)
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17n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-2 using rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127572
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-6-fluoro-4-methyl...)
Show SMILES CN1CC(Oc2ccc(F)cc12)C1=NCCN1
Show InChI InChI=1S/C12H14FN3O/c1-16-7-11(12-14-4-5-15-12)17-10-3-2-8(13)6-9(10)16/h2-3,6,11H,4-5,7H2,1H3,(H,14,15)
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17n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-2 using rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM81984
PNG
(CAS_29110-47-2 | GUANFACINE | Guanfacine | NSC_351...)
Show SMILES NC(=N)NC(=O)Cc1c(Cl)cccc1Cl
Show InChI InChI=1S/C9H9Cl2N3O/c10-6-2-1-3-7(11)5(6)4-8(15)14-9(12)13/h1-3H,4H2,(H4,12,13,14,15)
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19.0n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127591
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4,6-dimethyl-3,4-...)
Show SMILES CN1CC(Oc2ccc(C)cc12)C1=NCCN1
Show InChI InChI=1S/C13H17N3O/c1-9-3-4-11-10(7-9)16(2)8-12(17-11)13-14-5-6-15-13/h3-4,7,12H,5-6,8H2,1-2H3,(H,14,15)
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22n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM100152
PNG
(7-methoxy-1-methyl-9H-$b-carboline;hydrochloride |...)
Show SMILES COc1ccc2c(c1)[nH]c1c(C)nccc21
Show InChI InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3
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22n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards Imidazoline I2 receptor


Bioorg Med Chem Lett 13: 4421-5 (2003)

More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127599
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4,8-dimethyl-3,4-...)
Show SMILES CN1CC(Oc2c(C)cccc12)C1=NCCN1
Show InChI InChI=1S/C13H17N3O/c1-9-4-3-5-10-12(9)17-11(8-16(10)2)13-14-6-7-15-13/h3-5,11H,6-8H2,1-2H3,(H,14,15)
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23n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127572
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-6-fluoro-4-methyl...)
Show SMILES CN1CC(Oc2ccc(F)cc12)C1=NCCN1
Show InChI InChI=1S/C12H14FN3O/c1-16-7-11(12-14-4-5-15-12)17-10-3-2-8(13)6-9(10)16/h2-3,6,11H,4-5,7H2,1H3,(H,14,15)
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24n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In Vitro binding affinity for imidazoline receptor I-1 of rabbit kidney at 10e-7 M


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50240671
PNG
((5-Chloro-benzo[1,2,5]thiadiazol-4-yl)-(4,5-dihydr...)
Show SMILES Clc1ccc2nsnc2c1NC1=NCCN1
Show InChI InChI=1S/C9H8ClN5S/c10-5-1-2-6-8(15-16-14-6)7(5)13-9-11-3-4-12-9/h1-2H,3-4H2,(H2,11,12,13)
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28n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127578
PNG
(4-(4,5-Dihydro-1H-imidazol-2-yl)-1,2,3,4-tetrahydr...)
Show SMILES C1CN=C(N1)C1CN2CCc3cccc(O1)c23
Show InChI InChI=1S/C13H15N3O/c1-2-9-4-7-16-8-11(13-14-5-6-15-13)17-10(3-1)12(9)16/h1-3,11H,4-8H2,(H,14,15)
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33n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-2 using rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM96725
PNG
(2-[(E)-(2,6-dichlorobenzylidene)amino]guanidine | ...)
Show SMILES NC(N)=NN=Cc1c(Cl)cccc1Cl
Show InChI InChI=1S/C8H8Cl2N4/c9-6-2-1-3-7(10)5(6)4-13-14-8(11)12/h1-4H,(H4,11,12,14)
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34.7n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50138436
PNG
(CHEMBL146997 | N-(8-Guanidino-octyl)-N-(1-phenethy...)
Show SMILES CCC(=O)N(CCCCCCCCNC(N)=N)C1CCN(CCc2ccccc2)CC1
Show InChI InChI=1S/C25H43N5O/c1-2-24(31)30(18-11-6-4-3-5-10-17-28-25(26)27)23-15-20-29(21-16-23)19-14-22-12-8-7-9-13-22/h7-9,12-13,23H,2-6,10-11,14-21H2,1H3,(H4,26,27,28)
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37n/an/an/an/an/an/an/an/a



Organon Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards imidazoline receptor I-2


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50050094
PNG
(3-Isopropyl-bicyclo[2.2.1]hept-2-ylamine | CHEMBL4...)
Show SMILES CC(C)C1C2CCC(C2)C1N
Show InChI InChI=1S/C10H19N/c1-6(2)9-7-3-4-8(5-7)10(9)11/h6-10H,3-5,11H2,1-2H3
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42n/an/an/an/an/an/an/an/a



Allergan Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of [3H]-clonidine from bovine imidazoline receptor I-1


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127586
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4,6,7-trimethyl-3...)
Show SMILES CN1CC(Oc2cc(C)c(C)cc12)C1=NCCN1
Show InChI InChI=1S/C14H19N3O/c1-9-6-11-12(7-10(9)2)18-13(8-17(11)3)14-15-4-5-16-14/h6-7,13H,4-5,8H2,1-3H3,(H,15,16)
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43n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127586
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4,6,7-trimethyl-3...)
Show SMILES CN1CC(Oc2cc(C)c(C)cc12)C1=NCCN1
Show InChI InChI=1S/C14H19N3O/c1-9-6-11-12(7-10(9)2)18-13(8-17(11)3)14-15-4-5-16-14/h6-7,13H,4-5,8H2,1-3H3,(H,15,16)
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44n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50136493
PNG
(1-Methyl-4,9-dihydro-3H-beta-carboline | 1-methyl-...)
Show SMILES CC1=NCCc2c1[nH]c1ccccc21
Show InChI InChI=1S/C12H12N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-5,14H,6-7H2,1H3
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46n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards Imidazoline I1 receptor


Bioorg Med Chem Lett 13: 4421-5 (2003)

More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127592
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4,7-dimethyl-3,4-...)
Show SMILES CN1CC(Oc2cc(C)ccc12)C1=NCCN1
Show InChI InChI=1S/C13H17N3O/c1-9-3-4-10-11(7-9)17-12(8-16(10)2)13-14-5-6-15-13/h3-4,7,12H,5-6,8H2,1-2H3,(H,14,15)
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47n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-2 using rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127578
PNG
(4-(4,5-Dihydro-1H-imidazol-2-yl)-1,2,3,4-tetrahydr...)
Show SMILES C1CN=C(N1)C1CN2CCc3cccc(O1)c23
Show InChI InChI=1S/C13H15N3O/c1-2-9-4-7-16-8-11(13-14-5-6-15-13)17-10(3-1)12(9)16/h1-3,11H,4-8H2,(H,14,15)
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48n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127585
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-3,4-dihydro-2H-be...)
Show SMILES C1CN=C(N1)C1CNc2ccccc2O1
Show InChI InChI=1S/C11H13N3O/c1-2-4-9-8(3-1)14-7-10(15-9)11-12-5-6-13-11/h1-4,10,14H,5-7H2,(H,12,13)
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51n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-2 using rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50262233
PNG
(efaroxane)
Show SMILES CCC1(Cc2ccccc2O1)C1=[NH+]CCN1
Show InChI InChI=1S/C13H16N2O/c1-2-13(12-14-7-8-15-12)9-10-5-3-4-6-11(10)16-13/h3-6H,2,7-9H2,1H3,(H,14,15)/p+1
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52.4n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127599
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4,8-dimethyl-3,4-...)
Show SMILES CN1CC(Oc2c(C)cccc12)C1=NCCN1
Show InChI InChI=1S/C13H17N3O/c1-9-4-3-5-10-12(9)17-11(8-16(10)2)13-14-6-7-15-13/h3-5,11H,6-8H2,1-2H3,(H,14,15)
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54n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-2 using rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50016897
PNG
(2-(2,6-dichloroanilino)-1,3-diazacyclopentene-(2) ...)
Show SMILES Clc1cccc(Cl)c1N=C1NCCN1
Show InChI InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)
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55n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50050093
PNG
((4-Chloro-6-methoxy-2-methyl-pyrimidin-5-yl)-imida...)
Show SMILES COc1nc(C)nc(Cl)c1N=C1NCCN1
Show InChI InChI=1S/C9H12ClN5O/c1-5-13-7(10)6(8(14-5)16-2)15-9-11-3-4-12-9/h3-4H2,1-2H3,(H2,11,12,15)
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56n/an/an/an/an/an/an/an/a



Allergan Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of [3H]-clonidine from bovine imidazoline receptor I-1


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127575
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4-methyl-3,4-dihy...)
Show SMILES CN1CC(Oc2ccccc12)C1=NCCN1
Show InChI InChI=1S/C12H15N3O/c1-15-8-11(12-13-6-7-14-12)16-10-5-3-2-4-9(10)15/h2-5,11H,6-8H2,1H3,(H,13,14)
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56n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127572
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-6-fluoro-4-methyl...)
Show SMILES CN1CC(Oc2ccc(F)cc12)C1=NCCN1
Show InChI InChI=1S/C12H14FN3O/c1-16-7-11(12-14-4-5-15-12)17-10-3-2-8(13)6-9(10)16/h2-3,6,11H,4-5,7H2,1H3,(H,14,15)
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57n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127572
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-6-fluoro-4-methyl...)
Show SMILES CN1CC(Oc2ccc(F)cc12)C1=NCCN1
Show InChI InChI=1S/C12H14FN3O/c1-16-7-11(12-14-4-5-15-12)17-10-3-2-8(13)6-9(10)16/h2-3,6,11H,4-5,7H2,1H3,(H,14,15)
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57n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50262235
PNG
(rilmenidine)
Show SMILES C1CC1C(NC1=[NH+]CCO1)C1CC1
Show InChI InChI=1S/C10H16N2O/c1-2-7(1)9(8-3-4-8)12-10-11-5-6-13-10/h7-9H,1-6H2,(H,11,12)/p+1
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59.2n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127574
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-6-methoxy-4-methy...)
Show SMILES COc1ccc2OC(CN(C)c2c1)C1=NCCN1
Show InChI InChI=1S/C13H17N3O2/c1-16-8-12(13-14-5-6-15-13)18-11-4-3-9(17-2)7-10(11)16/h3-4,7,12H,5-6,8H2,1-2H3,(H,14,15)
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67n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50086502
PNG
(2-BFi | 2-Benzofuran-2-yl-4,5-dihydro-1H-imidazole...)
Show SMILES C1CN=C(N1)c1cc2ccccc2o1
Show InChI InChI=1S/C11H10N2O/c1-2-4-9-8(3-1)7-10(14-9)11-12-5-6-13-11/h1-4,7H,5-6H2,(H,12,13)
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70n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity for rat imidazoline receptor I-1 from crude P2 membranes


Bioorg Med Chem Lett 14: 527-9 (2003)

More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127574
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-6-methoxy-4-methy...)
Show SMILES COc1ccc2OC(CN(C)c2c1)C1=NCCN1
Show InChI InChI=1S/C13H17N3O2/c1-16-8-12(13-14-5-6-15-13)18-11-4-3-9(17-2)7-10(11)16/h3-4,7,12H,5-6,8H2,1-2H3,(H,14,15)
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79n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127595
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4-methyl-3,4-dihy...)
Show SMILES COC(=O)c1ccc2OC(CN(C)c2c1)C1=NCCN1
Show InChI InChI=1S/C14H17N3O3/c1-17-8-12(13-15-5-6-16-13)20-11-4-3-9(7-10(11)17)14(18)19-2/h3-4,7,12H,5-6,8H2,1-2H3,(H,15,16)
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88n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127579
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4-methyl-3,4-dihy...)
Show SMILES CN1CC(Oc2cc3ccccc3cc12)C1=NCCN1
Show InChI InChI=1S/C16H17N3O/c1-19-10-15(16-17-6-7-18-16)20-14-9-12-5-3-2-4-11(12)8-13(14)19/h2-5,8-9,15H,6-7,10H2,1H3,(H,17,18)
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93n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50027060
PNG
(2-(2-Cyclopropyl-phenoxymethyl)-4,5-dihydro-1H-imi...)
Show SMILES C(Oc1ccccc1C1CC1)C1=NCCN1
Show InChI InChI=1S/C13H16N2O/c1-2-4-12(11(3-1)10-5-6-10)16-9-13-14-7-8-15-13/h1-4,10H,5-9H2,(H,14,15)
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99n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127576
PNG
(CHEMBL58187 | [2-(4,5-Dihydro-1H-imidazol-2-yl)-4-...)
Show SMILES CN1CC(Oc2ccc(CO)cc12)C1=NCCN1
Show InChI InChI=1S/C13H17N3O2/c1-16-7-12(13-14-4-5-15-13)18-11-3-2-9(8-17)6-10(11)16/h2-3,6,12,17H,4-5,7-8H2,1H3,(H,14,15)
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100n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-2 using rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50001922
PNG
(2-Naphthalen-1-ylmethyl-4,5-dihydro-1H-imidazole; ...)
Show SMILES C(C1=NCCN1)c1cccc2ccccc12
Show InChI InChI=1S/C14H14N2/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14/h1-7H,8-10H2,(H,15,16)
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122n/an/an/an/an/an/an/an/a



University of Belgrade

Curated by ChEMBL


Assay Description
Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50127584
PNG
(6-Chloro-2-(4,5-dihydro-1H-imidazol-2-yl)-4-methyl...)
Show SMILES CN1CC(Oc2ccc(Cl)cc12)C1=NCCN1
Show InChI InChI=1S/C12H14ClN3O/c1-16-7-11(12-14-4-5-15-12)17-10-3-2-8(13)6-9(10)16/h2-3,6,11H,4-5,7H2,1H3,(H,14,15)
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140n/an/an/an/an/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
In vitro binding affinity determined against imidazoline receptor I-1 from rabbit kidney preparation


Citation and Details
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens)
BDBM50136493
PNG
(1-Methyl-4,9-dihydro-3H-beta-carboline | 1-methyl-...)
Show SMILES CC1=NCCc2c1[nH]c1ccccc21
Show InChI InChI=1S/C12H12N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-5,14H,6-7H2,1H3
PDB
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KEGG

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antibodypedia
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CHEMBL
PC cid
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PubMed
148n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards Imidazoline I2 receptor


Bioorg Med Chem Lett 13: 4421-5 (2003)

More data for this
Ligand-Target Pair
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