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Compile Data Set for Download or QSAR

Found 277 hits Enz. Inhib. hit(s) with Target = 'Nischarin' AND taxid = 9606   
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
Nischarin


(Homo sapiens (Human))
BDBM215802
PNG
(US9303019, 8)
Show SMILES CC1CN=C(C1)Nc1ccc(Cl)c2CCCc12 |c:3|
Show InChI InChI=1S/C14H17ClN2/c1-9-7-14(16-8-9)17-13-6-5-12(15)10-3-2-4-11(10)13/h5-6,9H,2-4,7-8H2,1H3,(H,16,17)
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US Patent
0.220 -57.3n/an/an/an/an/a7.3537



UNIVERSITE DE STRASBOURG

US Patent


Assay Description
Binding assays were performed at 37° C. using [125I]LNP 911 as radioligand following the general procedure described but adapted to washed whole ...


US Patent US9303019 (2016)


BindingDB Entry DOI: 10.7270/Q2N878NR
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50240366
PNG
(2-(naphthalen-2-yl)-4,5-dihydro-1H-imidazole | 2-N...)
Show SMILES C1CN=C(N1)c1ccc2ccccc2c1 |c:2|
Show InChI InChI=1S/C13H12N2/c1-2-4-11-9-12(6-5-10(11)3-1)13-14-7-8-15-13/h1-6,9H,7-8H2,(H,14,15)
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0.631n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473137
PNG
(CHEMBL14097)
Show SMILES Cc1ccccc1OCC1=NCCN1 |t:10|
Show InChI InChI=1S/C11H14N2O/c1-9-4-2-3-5-10(9)14-8-11-12-6-7-13-11/h2-5H,6-8H2,1H3,(H,12,13)
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0.794n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50179395
PNG
(CHEMBL14640)
Show SMILES C(Oc1ccccc1)C1=NCCN1 |t:9|
Show InChI InChI=1S/C10H12N2O/c1-2-4-9(5-3-1)13-8-10-11-6-7-12-10/h1-5H,6-8H2,(H,11,12)
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1n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50091345
PNG
(CHEMBL2092861)
Show SMILES C[C@@H](Cc1ccccc1)C1=NCCN1 |r,t:10|
Show InChI InChI=1S/C12H16N2/c1-10(12-13-7-8-14-12)9-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,13,14)/t10-/m0/s1
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1.10n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Displacement of [125I]p-iodoclonidine from imidazoline receptor I-1 in rat pheochromocytoma cells


J Med Chem 46: 2169-76 (2003)


Article DOI: 10.1021/jm021113r
BindingDB Entry DOI: 10.7270/Q2HH6NSW
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473154
PNG
(CHEMBL14107)
Show SMILES C=CCc1ccccc1OCC1=NCCN1 |t:12|
Show InChI InChI=1S/C13H16N2O/c1-2-5-11-6-3-4-7-12(11)16-10-13-14-8-9-15-13/h2-4,6-7H,1,5,8-10H2,(H,14,15)
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1.30n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50240365
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-quinoline | 2-(4,...)
Show SMILES C1CN=C(N1)c1ccc2ccccc2n1 |c:2|
Show InChI InChI=1S/C12H11N3/c1-2-4-10-9(3-1)5-6-11(15-10)12-13-7-8-14-12/h1-6H,7-8H2,(H,13,14)
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1.60n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473173
PNG
(CHEMBL418536)
Show SMILES C1CN=C(N1)c1cccc2ccccc12 |c:2|
Show InChI InChI=1S/C13H12N2/c1-2-6-11-10(4-1)5-3-7-12(11)13-14-8-9-15-13/h1-7H,8-9H2,(H,14,15)
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1.60n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50086502
PNG
(2-BFi | 2-Benzofuran-2-yl-4,5-dihydro-1H-imidazole...)
Show SMILES C1CN=C(N1)c1cc2ccccc2o1 |c:2|
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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1.60n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473145
PNG
(Fenoxazoline)
Show SMILES CC(C)c1ccccc1OCC1=NCCN1 |t:12|
Show InChI InChI=1S/C13H18N2O/c1-10(2)11-5-3-4-6-12(11)16-9-13-14-7-8-15-13/h3-6,10H,7-9H2,1-2H3,(H,14,15)
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2n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50138500
PNG
(2-((E)-Styryl)-4,5-dihydro-1H-imidazole | 2-styryl...)
Show SMILES C1CN=C(N1)\C=C\c1ccccc1 |c:2|
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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2n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473171
PNG
(CHEMBL279200)
Show SMILES C(Oc1cccc2ccccc12)C1=NCCN1 |t:14|
Show InChI InChI=1S/C14H14N2O/c1-2-6-12-11(4-1)5-3-7-13(12)17-10-14-15-8-9-16-14/h1-7H,8-10H2,(H,15,16)
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2n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50127591
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4,6-dimethyl-3,4-...)
Show SMILES CN1CC(Oc2ccc(C)cc12)C1=NCCN1 |t:14|
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



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50127591
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4,6-dimethyl-3,4-...)
Show SMILES CN1CC(Oc2ccc(C)cc12)C1=NCCN1 |t:14|
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


J Med Chem 46: 1962-79 (2003)


Article DOI: 10.1021/jm021050c
BindingDB Entry DOI: 10.7270/Q22806Z1
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473141
PNG
(CHEMBL266861)
Show SMILES C1CN=C(N1)c1cc2c(ccc3ccccc23)o1 |c:2|
Show InChI InChI=1S/C15H12N2O/c1-2-4-11-10(3-1)5-6-13-12(11)9-14(18-13)15-16-7-8-17-15/h1-6,9H,7-8H2,(H,16,17)
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2.5n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473136
PNG
(CHEMBL13343)
Show SMILES C1CN=C(N1)c1ccc2[nH]ccc2c1 |c:2|
Show InChI InChI=1S/C11H11N3/c1-2-10-8(3-4-12-10)7-9(1)11-13-5-6-14-11/h1-4,7,12H,5-6H2,(H,13,14)
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Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473184
PNG
(CHEMBL13887)
Show SMILES CCc1ccccc1OCC1=NCCN1 |t:11|
Show InChI InChI=1S/C12H16N2O/c1-2-10-5-3-4-6-11(10)15-9-12-13-7-8-14-12/h3-6H,2,7-9H2,1H3,(H,13,14)
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2.5n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50138499
PNG
(2-Phenethyl-4,5-dihydro-1H-imidazole | CHEMBL14210)
Show SMILES C(Cc1ccccc1)C1=NCCN1 |t:9|
Show InChI InChI=1S/C11H14N2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h1-5H,6-9H2,(H,12,13)
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2.5n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM215803
PNG
(US9303019, 9)
Show SMILES CC1CN=C(C1)Nc1ccc(C)c2CCCc12 |c:3|
Show InChI InChI=1S/C15H20N2/c1-10-8-15(16-9-10)17-14-7-6-11(2)12-4-3-5-13(12)14/h6-7,10H,3-5,8-9H2,1-2H3,(H,16,17)
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US Patent
2.80 -50.8n/an/an/an/an/a7.3537



UNIVERSITE DE STRASBOURG

US Patent


Assay Description
Binding assays were performed at 37° C. using [125I]LNP 911 as radioligand following the general procedure described but adapted to washed whole ...


US Patent US9303019 (2016)


BindingDB Entry DOI: 10.7270/Q2N878NR
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM215805
PNG
(US9303019, 20)
Show SMILES CC1CCC(Nc2ccc(Cl)c3CCCc23)=N1 |c:17|
Show InChI InChI=1S/C14H17ClN2/c1-9-5-8-14(16-9)17-13-7-6-12(15)10-3-2-4-11(10)13/h6-7,9H,2-5,8H2,1H3,(H,16,17)
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2.80 -50.8n/an/an/an/an/a7.3537



UNIVERSITE DE STRASBOURG

US Patent


Assay Description
Binding assays were performed at 37° C. using [125I]LNP 911 as radioligand following the general procedure described but adapted to washed whole ...


US Patent US9303019 (2016)


BindingDB Entry DOI: 10.7270/Q2N878NR
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473161
PNG
(CHEMBL267801)
Show SMILES Cc1ccc(cc1F)C1=NCCN1 |t:9|
Show InChI InChI=1S/C10H11FN2/c1-7-2-3-8(6-9(7)11)10-12-4-5-13-10/h2-3,6H,4-5H2,1H3,(H,12,13)
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3.20n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473175
PNG
(CHEMBL13631)
Show SMILES C1CN=C(N1)c1cnc2ccccc2c1 |c:2|
Show InChI InChI=1S/C12H11N3/c1-2-4-11-9(3-1)7-10(8-15-11)12-13-5-6-14-12/h1-4,7-8H,5-6H2,(H,13,14)
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3.20n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473196
PNG
(CHEMBL276276)
Show SMILES CSc1ccc(cc1)C1=NCCN1 |t:9|
Show InChI InChI=1S/C10H12N2S/c1-13-9-4-2-8(3-5-9)10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H,11,12)
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4n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50027060
PNG
(2-(2-Cyclopropyl-phenoxymethyl)-4,5-dihydro-1H-imi...)
Show SMILES C(Oc1ccccc1C1CC1)C1=NCCN1 |t:13|
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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4n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473166
PNG
(CHEMBL14203)
Show SMILES C1CN=C(N1)C1=Cc2ccccc2OC1 |c:2,t:6|
Show InChI InChI=1S/C12H12N2O/c1-2-4-11-9(3-1)7-10(8-15-11)12-13-5-6-14-12/h1-4,7H,5-6,8H2,(H,13,14)
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4n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473178
PNG
(CHEMBL13892)
Show SMILES C(Oc1ccc2ccccc2c1)C1=NCCN1 |t:14|
Show InChI InChI=1S/C14H14N2O/c1-2-4-12-9-13(6-5-11(12)3-1)17-10-14-15-7-8-16-14/h1-6,9H,7-8,10H2,(H,15,16)
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4n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50050093
PNG
((4-Chloro-6-methoxy-2-methyl-pyrimidin-5-yl)-imida...)
Show SMILES [#6]-[#8]-c1nc(-[#6])nc(Cl)c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1
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


Bioorg Med Chem 16: 7134-40 (2008)


Article DOI: 10.1016/j.bmc.2008.06.051
BindingDB Entry DOI: 10.7270/Q2FX7BCP
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50021809
PNG
((2,6-Dichloro-4-iodo-phenyl)-(4,5-dihydro-1H-imida...)
Show SMILES Clc1cc(I)cc(Cl)c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1
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


Bioorg Med Chem 16: 7134-40 (2008)


Article DOI: 10.1016/j.bmc.2008.06.051
BindingDB Entry DOI: 10.7270/Q2FX7BCP
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473139
PNG
(CHEMBL14528)
Show SMILES Cc1c(cccc1C1=NCCN1)C#N |t:8|
Show InChI InChI=1S/C11H11N3/c1-8-9(7-12)3-2-4-10(8)11-13-5-6-14-11/h2-4H,5-6H2,1H3,(H,13,14)
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5n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50091347
PNG
(CHEMBL71429)
Show SMILES CC(Cc1ccccc1)C1=NCCN1 |t:10|
Show InChI InChI=1S/C12H16N2/c1-10(12-13-7-8-14-12)9-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,13,14)
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5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Displacement of [125I]p-iodoclonidine from imidazoline receptor I-1 in rat pheochromocytoma cells


J Med Chem 46: 2169-76 (2003)


Article DOI: 10.1021/jm021113r
BindingDB Entry DOI: 10.7270/Q2HH6NSW
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473164
PNG
(CHEMBL268945)
Show SMILES C1CN=C(N1)c1ccc2OCOc2c1 |c:2|
Show InChI InChI=1S/C10H10N2O2/c1-2-8-9(14-6-13-8)5-7(1)10-11-3-4-12-10/h1-2,5H,3-4,6H2,(H,11,12)
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5n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50240364
PNG
(2-(4-Methoxy-phenyl)-4,5-dihydro-1H-imidazole | 2-...)
Show SMILES COc1ccc(cc1)C1=NCCN1 |t:9|
Show InChI InChI=1S/C10H12N2O/c1-13-9-4-2-8(3-5-9)10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H,11,12)
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5n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473204
PNG
(CHEMBL276487)
Show SMILES Cc1cccc(c1)C1=NCCN1 |t:8|
Show InChI InChI=1S/C10H12N2/c1-8-3-2-4-9(7-8)10-11-5-6-12-10/h2-4,7H,5-6H2,1H3,(H,11,12)
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5n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50412317
PNG
(CHEMBL468161)
Show SMILES CC1CCC(Nc2cc(N[N+]#N)c(I)cc2Cl)=N1 |c:17|
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


Bioorg Med Chem 16: 7134-40 (2008)


Article DOI: 10.1016/j.bmc.2008.06.051
BindingDB Entry DOI: 10.7270/Q2FX7BCP
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
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 |t:11|
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


Bioorg Med Chem 16: 7134-40 (2008)


Article DOI: 10.1016/j.bmc.2008.06.051
BindingDB Entry DOI: 10.7270/Q2FX7BCP
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473179
PNG
(CHEMBL13917)
Show SMILES CCCc1ccccc1OCC1=NCCN1 |t:12|
Show InChI InChI=1S/C13H18N2O/c1-2-5-11-6-3-4-7-12(11)16-10-13-14-8-9-15-13/h3-4,6-7H,2,5,8-10H2,1H3,(H,14,15)
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6.30n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50070329
PNG
(CHEMBL268734)
Show SMILES Cc1ccc(F)c(c1)C1=NCCN1 |t:9|
Show InChI InChI=1S/C10H11FN2/c1-7-2-3-9(11)8(6-7)10-12-4-5-13-10/h2-3,6H,4-5H2,1H3,(H,12,13)
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6.30n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
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 |t:17|
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


J Med Chem 46: 1962-79 (2003)


Article DOI: 10.1021/jm021050c
BindingDB Entry DOI: 10.7270/Q22806Z1
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50019848
PNG
(2-(2,3-dihydro-1,4-benzodioxin-2-yl)-4,5-dihydro-1...)
Show SMILES C1CN=C(N1)C1COc2ccccc2O1 |c:2|
Show InChI InChI=1S/C11H12N2O2/c1-2-4-9-8(3-1)14-7-10(15-9)11-12-5-6-13-11/h1-4,10H,5-7H2,(H,12,13)
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7.90n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50127575
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-4-methyl-3,4-dihy...)
Show SMILES CN1CC(Oc2ccccc12)C1=NCCN1 |t:13|
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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7.90n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50240362
PNG
(2-p-tolyl-4,5-dihydro-1H-imidazole | CHEMBL269197)
Show SMILES Cc1ccc(cc1)C1=NCCN1 |t:8|
Show InChI InChI=1S/C10H12N2/c1-8-2-4-9(5-3-8)10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H,11,12)
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7.90n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM215800
PNG
(US9303019, 1)
Show SMILES CC1CN=C(C1)Nc1cccc(Cl)c1C |c:3|
Show InChI InChI=1S/C12H15ClN2/c1-8-6-12(14-7-8)15-11-5-3-4-10(13)9(11)2/h3-5,8H,6-7H2,1-2H3,(H,14,15)
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US Patent
8.10 -48.0n/an/an/an/an/a7.3537



UNIVERSITE DE STRASBOURG

US Patent


Assay Description
Binding assays were performed at 37° C. using [125I]LNP 911 as radioligand following the general procedure described but adapted to washed whole ...


US Patent US9303019 (2016)


BindingDB Entry DOI: 10.7270/Q2N878NR
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50016897
PNG
(2-(2,6-dichloroanilino)-1,3-diazacyclopentene-(2) ...)
Show SMILES Clc1cccc(Cl)c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1
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


J Med Chem 39: 1193-5 (1996)


Article DOI: 10.1021/jm960012o
BindingDB Entry DOI: 10.7270/Q2NZ889J
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50127600
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-2,3,5,6-tetrahydr...)
Show SMILES C1CN=C(N1)C1CN2CCCc3cccc(O1)c23 |c:2|
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



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473155
PNG
(CHEMBL266386)
Show SMILES C1CN=C(N1)C1=Cc2ccccc2CC1 |c:2,t:6|
Show InChI InChI=1S/C13H14N2/c1-2-4-11-9-12(6-5-10(11)3-1)13-14-7-8-15-13/h1-4,9H,5-8H2,(H,14,15)
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10n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473174
PNG
(CHEMBL14174)
Show SMILES C\C(=C/c1ccccc1)C1=NCCN1 |t:10|
Show InChI InChI=1S/C12H14N2/c1-10(12-13-7-8-14-12)9-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3,(H,13,14)/b10-9+
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10n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50127600
PNG
(2-(4,5-Dihydro-1H-imidazol-2-yl)-2,3,5,6-tetrahydr...)
Show SMILES C1CN=C(N1)C1CN2CCCc3cccc(O1)c23 |c:2|
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


J Med Chem 46: 1962-79 (2003)


Article DOI: 10.1021/jm021050c
BindingDB Entry DOI: 10.7270/Q22806Z1
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50138500
PNG
(2-((E)-Styryl)-4,5-dihydro-1H-imidazole | 2-styryl...)
Show SMILES C1CN=C(N1)\C=C\c1ccccc1 |c:2|
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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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)


BindingDB Entry DOI: 10.7270/Q20G3JKT
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473176
PNG
(CHEMBL278221)
Show SMILES Cc1ccccc1C1=NCCN1 |t:8|
Show InChI InChI=1S/C10H12N2/c1-8-4-2-3-5-9(8)10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H,11,12)
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10n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
Nischarin


(Homo sapiens (Human))
BDBM50473181
PNG
(CHEMBL13824)
Show SMILES COc1ccc2cc(ccc2c1)C1=NCCN1 |t:14|
Show InChI InChI=1S/C14H14N2O/c1-17-13-5-4-10-8-12(3-2-11(10)9-13)14-15-6-7-16-14/h2-5,8-9H,6-7H2,1H3,(H,15,16)
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10n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair
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