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Compile Data Set for Download or QSAR

Found 34 hits with Last Name = 'stiebing' and Initial = 's'   
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
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91581
PNG
(Thiaindanone, 3)
Show SMILES Fc1ccccc1CN1CCN(CC(=O)NC2CC(N=O)c3c(Br)sc(Br)c23)CC1
Show InChI InChI=1S/C20H21Br2FN4O2S/c21-19-17-14(9-15(25-29)18(17)20(22)30-19)24-16(28)11-27-7-5-26(6-8-27)10-12-3-1-2-4-13(12)23/h1-4,14-15H,5-11H2,(H,24,28)
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n/an/a 60n/an/an/an/a7.4n/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91580
PNG
(Thiaindanone, 2)
Show SMILES Fc1ccccc1CN1CCN(CC(=O)NC2CC(=O)c3c(Br)sc(Br)c23)CC1
Show InChI InChI=1S/C20H20Br2FN3O2S/c21-19-17-14(9-15(27)18(17)20(22)29-19)24-16(28)11-26-7-5-25(6-8-26)10-12-3-1-2-4-13(12)23/h1-4,14H,5-11H2,(H,24,28)
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n/an/a 400n/an/an/an/a7.4n/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91582
PNG
(Thiaindanone, 11)
Show SMILES OC1CC(NC(=O)CN2CCN(Cc3ccccc3F)CC2)c2c(Br)sc(Br)c12
Show InChI InChI=1S/C20H22Br2FN3O2S/c21-19-17-14(9-15(27)18(17)20(22)29-19)24-16(28)11-26-7-5-25(6-8-26)10-12-3-1-2-4-13(12)23/h1-4,14-15,27H,5-11H2,(H,24,28)
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n/an/a 400n/an/an/an/a7.4n/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91587
PNG
(Thiaindanone, 1)
Show SMILES Brc1sc(Br)c2C(=O)CC(NC(=O)CN3CCN(Cc4ccccc4)CC3)c12
Show InChI InChI=1S/C20H21Br2N3O2S/c21-19-17-14(10-15(26)18(17)20(22)28-19)23-16(27)12-25-8-6-24(7-9-25)11-13-4-2-1-3-5-13/h1-5,14H,6-12H2,(H,23,27)
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n/an/a 560n/an/an/an/a7.4n/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209245
PNG
(CHEMBL247378)
Show SMILES [O-][N+](=O)c1cccc2cn[nH]c12
Show InChI InChI=1S/C7H5N3O2/c11-10(12)6-3-1-2-5-4-8-9-7(5)6/h1-4H,(H,8,9)
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n/an/a 600n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91584
PNG
(Thiaindanone, 13)
Show SMILES Fc1ccccc1CN1CCN(CC(=O)NC2CC(Cl)c3c(Br)sc(Br)c23)CC1
Show InChI InChI=1S/C20H21Br2ClFN3OS/c21-19-17-13(23)9-15(18(17)20(22)29-19)25-16(28)11-27-7-5-26(6-8-27)10-12-3-1-2-4-14(12)24/h1-4,13,15H,5-11H2,(H,25,28)
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n/an/a 630n/an/an/an/a7.4n/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91585
PNG
(Thiaindanone, 14)
Show SMILES NN=C1CC(NC(=O)CN2CCN(Cc3ccccc3F)CC2)c2c(Br)sc(Br)c12 |w:1.0|
Show InChI InChI=1S/C20H22Br2FN5OS/c21-19-17-14(9-15(26-24)18(17)20(22)30-19)25-16(29)11-28-7-5-27(6-8-28)10-12-3-1-2-4-13(12)23/h1-4,14H,5-11,24H2,(H,25,29)
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n/an/a 1.50E+3n/an/an/an/a7.4n/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91583
PNG
(Thiaindanone, 12)
Show SMILES FC1CC(NC(=O)CN2CCN(Cc3ccccc3F)CC2)c2c(Br)sc(Br)c12
Show InChI InChI=1S/C20H21Br2F2N3OS/c21-19-17-14(24)9-15(18(17)20(22)29-19)25-16(28)11-27-7-5-26(6-8-27)10-12-3-1-2-4-13(12)23/h1-4,14-15H,5-11H2,(H,25,28)
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n/an/a 2.30E+3n/an/an/an/a7.4n/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209241
PNG
(4-bromo-1H-indazole | CHEMBL246393)
Show SMILES Brc1cccc2[nH]ncc12
Show InChI InChI=1S/C7H5BrN2/c8-6-2-1-3-7-5(6)4-9-10-7/h1-4H,(H,9,10)
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n/an/a 2.40E+3n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209244
PNG
(7-chloro-1H-indazole | CHEMBL247367)
Show SMILES Clc1cccc2cn[nH]c12
Show InChI InChI=1S/C7H5ClN2/c8-6-3-1-2-5-4-9-10-7(5)6/h1-4H,(H,9,10)
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n/an/a 4.20E+3n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209237
PNG
(6-bromo-1H-indazole | CHEMBL247365)
Show SMILES Brc1ccc2cn[nH]c2c1
Show InChI InChI=1S/C7H5BrN2/c8-6-2-1-5-4-9-10-7(5)3-6/h1-4H,(H,9,10)
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n/an/a 4.30E+3n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91590
PNG
(Thiaindanone, 19)
Show SMILES Brc1sc(Br)c2C(=O)CC(NC(=O)CCCN3CCc4ccccc4C3)c12
Show InChI InChI=1S/C20H20Br2N2O2S/c21-19-17-14(10-15(25)18(17)20(22)27-19)23-16(26)6-3-8-24-9-7-12-4-1-2-5-13(12)11-24/h1-2,4-5,14H,3,6-11H2,(H,23,26)
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n/an/a>5.00E+3n/an/an/an/a7.4n/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91588
PNG
(Thiaindanone, 16)
Show SMILES Brc1sc(Br)c2C(=O)CC(NC(=O)CCCCCCc3ccccc3)c12
Show InChI InChI=1S/C20H21Br2NO2S/c21-19-17-14(12-15(24)18(17)20(22)26-19)23-16(25)11-7-2-1-4-8-13-9-5-3-6-10-13/h3,5-6,9-10,14H,1-2,4,7-8,11-12H2,(H,23,25)
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n/an/a>5.00E+3n/an/an/an/a7.4n/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91586
PNG
(Thiaindanone, 15)
Show SMILES Fc1ccccc1CN1CCN(CC(=O)NC2C\C(=C/C#C)c3c(Br)sc(Br)c23)CC1
Show InChI InChI=1S/C23H22Br2FN3OS/c1-2-5-15-12-18(21-20(15)22(24)31-23(21)25)27-19(30)14-29-10-8-28(9-11-29)13-16-6-3-4-7-17(16)26/h1,3-7,18H,8-14H2,(H,27,30)/b15-5+
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Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM91589
PNG
(Thiaindanone, 17)
Show SMILES Brc1sc(Br)c2C(=O)CC(NC(=O)CCc3c[nH]c4ccccc34)c12
Show InChI InChI=1S/C18H14Br2N2O2S/c19-17-15-12(7-13(23)16(15)18(20)25-17)22-14(24)6-5-9-8-21-11-4-2-1-3-10(9)11/h1-4,8,12,21H,5-7H2,(H,22,24)
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Centre d'Etudes et de Recherche sur le Médicament de Normandie



Assay Description
Inhibitory ability of compounds on AChE activity was evaluated through the use of the spectrometic method of Ellman. Lyophilized electric eel AChE (...


J Enzyme Inhib Med Chem 23: 696-703 (2008)


Article DOI: 10.1080/14756360802208053
BindingDB Entry DOI: 10.7270/Q2SX6BT7
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50390019
PNG
(CHEMBL2071543)
Show SMILES Cn1ncc2c(cccc12)[N+]([O-])=O
Show InChI InChI=1S/C8H7N3O2/c1-10-7-3-2-4-8(11(12)13)6(7)5-9-10/h2-5H,1H3
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n/an/a 1.06E+4n/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Inhibition of nNOS in rat cerebellum homogenates assessed as reduction in conversion of L-[3H]arginine to L-[3H]citrulline


Bioorg Med Chem 20: 5296-304 (2012)


Article DOI: 10.1016/j.bmc.2012.06.025
BindingDB Entry DOI: 10.7270/Q26W9C46
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209239
PNG
(7-bromo-1H-indazole | CHEMBL439566)
Show SMILES Brc1cccc2cn[nH]c12
Show InChI InChI=1S/C7H5BrN2/c8-6-3-1-2-5-4-9-10-7(5)6/h1-4H,(H,9,10)
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n/an/a 1.43E+4n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209235
PNG
(4-iodo-1H-indazole | CHEMBL246534)
Show SMILES Ic1cccc2[nH]ncc12
Show InChI InChI=1S/C7H5IN2/c8-6-2-1-3-7-5(6)4-9-10-7/h1-4H,(H,9,10)
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n/an/a 1.70E+4n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209236
PNG
(6-Chloro-1H-indazole | CHEMBL392184)
Show SMILES Clc1ccc2cn[nH]c2c1
Show InChI InChI=1S/C7H5ClN2/c8-6-2-1-5-4-9-10-7(5)3-6/h1-4H,(H,9,10)
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n/an/a 2.20E+4n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50390023
PNG
(CHEMBL2071547)
Show SMILES Cn1ncc2c(Br)cccc12
Show InChI InChI=1S/C8H7BrN2/c1-11-8-4-2-3-7(9)6(8)5-10-11/h2-5H,1H3
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n/an/a 2.82E+4n/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Inhibition of nNOS in rat cerebellum homogenates assessed as reduction in conversion of L-[3H]arginine to L-[3H]citrulline


Bioorg Med Chem 20: 5296-304 (2012)


Article DOI: 10.1016/j.bmc.2012.06.025
BindingDB Entry DOI: 10.7270/Q26W9C46
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209243
PNG
(5-iodo-1H-indazole | CHEMBL391348)
Show SMILES Ic1ccc2[nH]ncc2c1
Show InChI InChI=1S/C7H5IN2/c8-6-1-2-7-5(3-6)4-9-10-7/h1-4H,(H,9,10)
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n/an/a 3.70E+4n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50390027
PNG
(CHEMBL2071551)
Show SMILES N#Cc1cccc2[nH]ncc12
Show InChI InChI=1S/C8H5N3/c9-4-6-2-1-3-8-7(6)5-10-11-8/h1-3,5H,(H,10,11)
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n/an/a 4.25E+4n/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Inhibition of nNOS in rat cerebellum homogenates assessed as reduction in conversion of L-[3H]arginine to L-[3H]citrulline


Bioorg Med Chem 20: 5296-304 (2012)


Article DOI: 10.1016/j.bmc.2012.06.025
BindingDB Entry DOI: 10.7270/Q26W9C46
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209234
PNG
(4-chloro-1H-indazole | CHEMBL246533)
Show SMILES Clc1cccc2[nH]ncc12
Show InChI InChI=1S/C7H5ClN2/c8-6-2-1-3-7-5(6)4-9-10-7/h1-4H,(H,9,10)
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n/an/a 4.43E+4n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50390021
PNG
(CHEMBL2071545)
Show SMILES CCn1ncc2c(cccc12)[N+]([O-])=O
Show InChI InChI=1S/C9H9N3O2/c1-2-11-8-4-3-5-9(12(13)14)7(8)6-10-11/h3-6H,2H2,1H3
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n/an/a 5.17E+4n/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Inhibition of nNOS in rat cerebellum homogenates assessed as reduction in conversion of L-[3H]arginine to L-[3H]citrulline


Bioorg Med Chem 20: 5296-304 (2012)


Article DOI: 10.1016/j.bmc.2012.06.025
BindingDB Entry DOI: 10.7270/Q26W9C46
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209242
PNG
(5-chloro-1H-indazole | CHEMBL246746)
Show SMILES Clc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C7H5ClN2/c8-6-1-2-7-5(3-6)4-9-10-7/h1-4H,(H,9,10)
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n/an/a 5.93E+4n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50099398
PNG
(5-Bromo-1H-indazole | CHEMBL16425 | cid_761929)
Show SMILES Brc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C7H5BrN2/c8-6-1-2-7-5(3-6)4-9-10-7/h1-4H,(H,9,10)
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n/an/a 7.20E+4n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50390025
PNG
(CHEMBL2071549)
Show SMILES CCn1ncc2c(Br)cccc12
Show InChI InChI=1S/C9H9BrN2/c1-2-12-9-5-3-4-8(10)7(9)6-11-12/h3-6H,2H2,1H3
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n/an/a 7.25E+4n/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Inhibition of nNOS in rat cerebellum homogenates assessed as reduction in conversion of L-[3H]arginine to L-[3H]citrulline


Bioorg Med Chem 20: 5296-304 (2012)


Article DOI: 10.1016/j.bmc.2012.06.025
BindingDB Entry DOI: 10.7270/Q26W9C46
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50390026
PNG
(CHEMBL2071550)
Show SMILES CCn1cc2c(Br)cccc2n1
Show InChI InChI=1S/C9H9BrN2/c1-2-12-6-7-8(10)4-3-5-9(7)11-12/h3-6H,2H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Inhibition of nNOS in rat cerebellum homogenates assessed as reduction in conversion of L-[3H]arginine to L-[3H]citrulline


Bioorg Med Chem 20: 5296-304 (2012)


Article DOI: 10.1016/j.bmc.2012.06.025
BindingDB Entry DOI: 10.7270/Q26W9C46
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50390024
PNG
(CHEMBL2071548)
Show SMILES Cn1cc2c(Br)cccc2n1
Show InChI InChI=1S/C8H7BrN2/c1-11-5-6-7(9)3-2-4-8(6)10-11/h2-5H,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Inhibition of nNOS in rat cerebellum homogenates assessed as reduction in conversion of L-[3H]arginine to L-[3H]citrulline


Bioorg Med Chem 20: 5296-304 (2012)


Article DOI: 10.1016/j.bmc.2012.06.025
BindingDB Entry DOI: 10.7270/Q26W9C46
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50390022
PNG
(CHEMBL2071546)
Show SMILES CCn1cc2c(cccc2n1)[N+]([O-])=O
Show InChI InChI=1S/C9H9N3O2/c1-2-11-6-7-8(10-11)4-3-5-9(7)12(13)14/h3-6H,2H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Inhibition of nNOS in rat cerebellum homogenates assessed as reduction in conversion of L-[3H]arginine to L-[3H]citrulline


Bioorg Med Chem 20: 5296-304 (2012)


Article DOI: 10.1016/j.bmc.2012.06.025
BindingDB Entry DOI: 10.7270/Q26W9C46
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50390020
PNG
(CHEMBL2071544)
Show SMILES Cn1cc2c(cccc2n1)[N+]([O-])=O
Show InChI InChI=1S/C8H7N3O2/c1-10-5-6-7(9-10)3-2-4-8(6)11(12)13/h2-5H,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Universit£ de Caen Basse-Normandie

Curated by ChEMBL


Assay Description
Inhibition of nNOS in rat cerebellum homogenates assessed as reduction in conversion of L-[3H]arginine to L-[3H]citrulline


Bioorg Med Chem 20: 5296-304 (2012)


Article DOI: 10.1016/j.bmc.2012.06.025
BindingDB Entry DOI: 10.7270/Q26W9C46
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209238
PNG
(6-fluoro-1H-indazole | CHEMBL247366)
Show SMILES Fc1ccc2cn[nH]c2c1
Show InChI InChI=1S/C7H5FN2/c8-6-2-1-5-4-9-10-7(5)3-6/h1-4H,(H,9,10)
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n/an/a>1.00E+5n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50099405
PNG
(5-Fluoro-1H-indazole | CHEMBL16076)
Show SMILES Fc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C7H5FN2/c8-6-1-2-7-5(3-6)4-9-10-7/h1-4H,(H,9,10)
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n/an/a>1.00E+5n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50209240
PNG
(4-fluoro-1H-indazole | CHEMBL392263)
Show SMILES Fc1cccc2[nH]ncc12
Show InChI InChI=1S/C7H5FN2/c8-6-2-1-3-7-5(6)4-9-10-7/h1-4H,(H,9,10)
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n/an/a>1.00E+5n/an/an/an/an/an/a



UPRES-EA 3915

Curated by ChEMBL


Assay Description
Inhibition of rat neuronal NOS


Bioorg Med Chem Lett 17: 3177-80 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.024
BindingDB Entry DOI: 10.7270/Q2Z60NR3
More data for this
Ligand-Target Pair