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Compile Data Set for Download or QSAR

Found 61 hits with Last Name = 'de caprariis' and Initial = 'p'   
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
Metabotropic glutamate receptor 4


(Homo sapiens (Human))
BDBM50007548
PNG
((S)-2-Amino-4-phosphono-butyric acid | (S)-2-amino...)
Show SMILES N[C@@H](CCP(O)(O)=O)C(O)=O |r|
Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)/t3-/m0/s1
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PubMed
160n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR4 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM17657
PNG
((2S)-2-aminopentanedioic acid | (S)-Glu | D-Glutam...)
Show SMILES N[C@@H](CCC(O)=O)C(O)=O
Show InChI InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
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570n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR1A receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM17657
PNG
((2S)-2-aminopentanedioic acid | (S)-Glu | D-Glutam...)
Show SMILES N[C@@H](CCC(O)=O)C(O)=O
Show InChI InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
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1.16E+3n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR5 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 4


(Homo sapiens (Human))
BDBM17657
PNG
((2S)-2-aminopentanedioic acid | (S)-Glu | D-Glutam...)
Show SMILES N[C@@H](CCC(O)=O)C(O)=O
Show InChI InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
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1.40E+3n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR4 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM17657
PNG
((2S)-2-aminopentanedioic acid | (S)-Glu | D-Glutam...)
Show SMILES N[C@@H](CCC(O)=O)C(O)=O
Show InChI InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
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6.40E+3n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR2 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50254389
PNG
((2S)-2-(3'-Carboxymethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@@H](CC12CC(CC(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C10H15NO4/c11-6(8(14)15)1-9-3-10(4-9,5-9)2-7(12)13/h6H,1-5,11H2,(H,12,13)(H,14,15)/t6-,9?,10?/m0/s1
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5.90E+4n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR1A receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50254338
PNG
((2R)-3-(3'-Carboxybicyclo[1.1.1]pentyl)alanine | C...)
Show SMILES N[C@H](CC12CC(C1)(C2)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C9H13NO4/c10-5(6(11)12)1-8-2-9(3-8,4-8)7(13)14/h5H,1-4,10H2,(H,11,12)(H,13,14)/t5-,8?,9?/m1/s1
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2.10E+5n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR1A receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM50254389
PNG
((2S)-2-(3'-Carboxymethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@@H](CC12CC(CC(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C10H15NO4/c11-6(8(14)15)1-9-3-10(4-9,5-9)2-7(12)13/h6H,1-5,11H2,(H,12,13)(H,14,15)/t6-,9?,10?/m0/s1
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2.93E+5n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR5 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM50254391
PNG
((2S)-(3'-Phosphonomethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@@H](CC12CC(CP(O)(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C9H16NO5P/c10-6(7(11)12)1-8-2-9(3-8,4-8)5-16(13,14)15/h6H,1-5,10H2,(H,11,12)(H2,13,14,15)/t6-,8?,9?/m0/s1
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>3.00E+5n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR5 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM50254337
PNG
((2S)-3-(3'-Carboxybicyclo[1.1.1]pentyl)alanine | C...)
Show SMILES N[C@@H](CC12CC(C1)(C2)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C9H13NO4/c10-5(6(11)12)1-8-2-9(3-8,4-8)7(13)14/h5H,1-4,10H2,(H,11,12)(H,13,14)/t5-,8?,9?/m0/s1
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>3.00E+5n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR5 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50254391
PNG
((2S)-(3'-Phosphonomethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@@H](CC12CC(CP(O)(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C9H16NO5P/c10-6(7(11)12)1-8-2-9(3-8,4-8)5-16(13,14)15/h6H,1-5,10H2,(H,11,12)(H2,13,14,15)/t6-,8?,9?/m0/s1
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>3.00E+5n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR1A receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM50254390
PNG
((2R)-2-(3'-Carboxymethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@H](CC12CC(CC(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C10H15NO4/c11-6(8(14)15)1-9-3-10(4-9,5-9)2-7(12)13/h6H,1-5,11H2,(H,12,13)(H,14,15)/t6-,9?,10?/m1/s1
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>3.00E+5n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR5 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM50254338
PNG
((2R)-3-(3'-Carboxybicyclo[1.1.1]pentyl)alanine | C...)
Show SMILES N[C@H](CC12CC(C1)(C2)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C9H13NO4/c10-5(6(11)12)1-8-2-9(3-8,4-8)7(13)14/h5H,1-4,10H2,(H,11,12)(H,13,14)/t5-,8?,9?/m1/s1
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3.36E+5n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR5 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM50007548
PNG
((S)-2-Amino-4-phosphono-butyric acid | (S)-2-amino...)
Show SMILES N[C@@H](CCP(O)(O)=O)C(O)=O |r|
Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)/t3-/m0/s1
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>1.00E+6n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR5 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50007548
PNG
((S)-2-Amino-4-phosphono-butyric acid | (S)-2-amino...)
Show SMILES N[C@@H](CCP(O)(O)=O)C(O)=O |r|
Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)/t3-/m0/s1
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>1.00E+6n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR2 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 4


(Homo sapiens (Human))
BDBM50254389
PNG
((2S)-2-(3'-Carboxymethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@@H](CC12CC(CC(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C10H15NO4/c11-6(8(14)15)1-9-3-10(4-9,5-9)2-7(12)13/h6H,1-5,11H2,(H,12,13)(H,14,15)/t6-,9?,10?/m0/s1
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>1.00E+6n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR4 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50254390
PNG
((2R)-2-(3'-Carboxymethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@H](CC12CC(CC(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C10H15NO4/c11-6(8(14)15)1-9-3-10(4-9,5-9)2-7(12)13/h6H,1-5,11H2,(H,12,13)(H,14,15)/t6-,9?,10?/m1/s1
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>1.00E+6n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR1A receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50254390
PNG
((2R)-2-(3'-Carboxymethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@H](CC12CC(CC(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C10H15NO4/c11-6(8(14)15)1-9-3-10(4-9,5-9)2-7(12)13/h6H,1-5,11H2,(H,12,13)(H,14,15)/t6-,9?,10?/m1/s1
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>1.00E+6n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR2 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 4


(Homo sapiens (Human))
BDBM50254390
PNG
((2R)-2-(3'-Carboxymethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@H](CC12CC(CC(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C10H15NO4/c11-6(8(14)15)1-9-3-10(4-9,5-9)2-7(12)13/h6H,1-5,11H2,(H,12,13)(H,14,15)/t6-,9?,10?/m1/s1
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>1.00E+6n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR4 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 4


(Homo sapiens (Human))
BDBM50254392
PNG
((2R)-(3'-Phosphonomethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@H](CC12CC(CP(O)(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C9H16NO5P/c10-6(7(11)12)1-8-2-9(3-8,4-8)5-16(13,14)15/h6H,1-5,10H2,(H,11,12)(H2,13,14,15)/t6-,8?,9?/m1/s1
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>1.00E+6n/an/an/an/an/an/an/an/a



Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR4 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM50254392
PNG
((2R)-(3'-Phosphonomethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@H](CC12CC(CP(O)(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C9H16NO5P/c10-6(7(11)12)1-8-2-9(3-8,4-8)5-16(13,14)15/h6H,1-5,10H2,(H,11,12)(H2,13,14,15)/t6-,8?,9?/m1/s1
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Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR5 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50254392
PNG
((2R)-(3'-Phosphonomethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@H](CC12CC(CP(O)(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C9H16NO5P/c10-6(7(11)12)1-8-2-9(3-8,4-8)5-16(13,14)15/h6H,1-5,10H2,(H,11,12)(H2,13,14,15)/t6-,8?,9?/m1/s1
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Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR1A receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50254389
PNG
((2S)-2-(3'-Carboxymethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@@H](CC12CC(CC(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C10H15NO4/c11-6(8(14)15)1-9-3-10(4-9,5-9)2-7(12)13/h6H,1-5,11H2,(H,12,13)(H,14,15)/t6-,9?,10?/m0/s1
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Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR2 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 4


(Homo sapiens (Human))
BDBM50254338
PNG
((2R)-3-(3'-Carboxybicyclo[1.1.1]pentyl)alanine | C...)
Show SMILES N[C@H](CC12CC(C1)(C2)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C9H13NO4/c10-5(6(11)12)1-8-2-9(3-8,4-8)7(13)14/h5H,1-4,10H2,(H,11,12)(H,13,14)/t5-,8?,9?/m1/s1
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Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR4 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50254338
PNG
((2R)-3-(3'-Carboxybicyclo[1.1.1]pentyl)alanine | C...)
Show SMILES N[C@H](CC12CC(C1)(C2)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C9H13NO4/c10-5(6(11)12)1-8-2-9(3-8,4-8)7(13)14/h5H,1-4,10H2,(H,11,12)(H,13,14)/t5-,8?,9?/m1/s1
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Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR2 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 4


(Homo sapiens (Human))
BDBM50254337
PNG
((2S)-3-(3'-Carboxybicyclo[1.1.1]pentyl)alanine | C...)
Show SMILES N[C@@H](CC12CC(C1)(C2)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C9H13NO4/c10-5(6(11)12)1-8-2-9(3-8,4-8)7(13)14/h5H,1-4,10H2,(H,11,12)(H,13,14)/t5-,8?,9?/m0/s1
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Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR4 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50254337
PNG
((2S)-3-(3'-Carboxybicyclo[1.1.1]pentyl)alanine | C...)
Show SMILES N[C@@H](CC12CC(C1)(C2)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C9H13NO4/c10-5(6(11)12)1-8-2-9(3-8,4-8)7(13)14/h5H,1-4,10H2,(H,11,12)(H,13,14)/t5-,8?,9?/m0/s1
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Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR2 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50254337
PNG
((2S)-3-(3'-Carboxybicyclo[1.1.1]pentyl)alanine | C...)
Show SMILES N[C@@H](CC12CC(C1)(C2)C(O)=O)C(O)=O |r|
Show InChI InChI=1S/C9H13NO4/c10-5(6(11)12)1-8-2-9(3-8,4-8)7(13)14/h5H,1-4,10H2,(H,11,12)(H,13,14)/t5-,8?,9?/m0/s1
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Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR1A receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 4


(Homo sapiens (Human))
BDBM50254391
PNG
((2S)-(3'-Phosphonomethylbicyclo[1.1.1]pentyl)glyci...)
Show SMILES N[C@@H](CC12CC(CP(O)(O)=O)(C1)C2)C(O)=O |r|
Show InChI InChI=1S/C9H16NO5P/c10-6(7(11)12)1-8-2-9(3-8,4-8)5-16(13,14)15/h6H,1-5,10H2,(H,11,12)(H2,13,14,15)/t6-,8?,9?/m0/s1
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Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR4 receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50007548
PNG
((S)-2-Amino-4-phosphono-butyric acid | (S)-2-amino...)
Show SMILES N[C@@H](CCP(O)(O)=O)C(O)=O |r|
Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)/t3-/m0/s1
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Universit£ di Salerno

Curated by ChEMBL


Assay Description
Displacement of [3H]Quisqualate from human mGluR1A receptor expressed in BHK cells


Bioorg Med Chem 17: 242-50 (2008)


Article DOI: 10.1016/j.bmc.2008.11.015
BindingDB Entry DOI: 10.7270/Q2HD7WKF
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016516
PNG
(CHEMBL3260691)
Show SMILES CCOC(=O)c1c(CSc2c(C)cc(C)cc2C)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C22H25NO3S/c1-6-26-22(25)20-17-11-16(24)7-8-18(17)23(5)19(20)12-27-21-14(3)9-13(2)10-15(21)4/h7-11,24H,6,12H2,1-5H3
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n/an/a 230n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production from arachidonic acid preincubated for 15 mins by ...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM22332
PNG
(2-amino-5-hydroxyindole, 3n | ethyl 2-[(3-chloroph...)
Show SMILES CCOC(=O)c1c(Nc2cccc(Cl)c2)[nH]c2ccc(O)cc12
Show InChI InChI=1S/C17H15ClN2O3/c1-2-23-17(22)15-13-9-12(21)6-7-14(13)20-16(15)19-11-5-3-4-10(18)8-11/h3-9,19-21H,2H2,1H3
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n/an/a 300n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 5 to 10 mins by HPLC ana...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50000541
PNG
((+-)-1-(1-Benzo[b]thien-2-ylethyl)-1-hydroxyurea |...)
Show SMILES CC(N(O)C(N)=O)c1cc2ccccc2s1
Show InChI InChI=1S/C11H12N2O2S/c1-7(13(15)11(12)14)10-6-8-4-2-3-5-9(8)16-10/h2-7,15H,1H3,(H2,12,14)
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n/an/a 600n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 5 to 10 mins by HPLC ana...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50000541
PNG
((+-)-1-(1-Benzo[b]thien-2-ylethyl)-1-hydroxyurea |...)
Show SMILES CC(N(O)C(N)=O)c1cc2ccccc2s1
Show InChI InChI=1S/C11H12N2O2S/c1-7(13(15)11(12)14)10-6-8-4-2-3-5-9(8)16-10/h2-7,15H,1H3,(H2,12,14)
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n/an/a 700n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production from arachidonic acid preincubated for 15 mins by ...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016516
PNG
(CHEMBL3260691)
Show SMILES CCOC(=O)c1c(CSc2c(C)cc(C)cc2C)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C22H25NO3S/c1-6-26-22(25)20-17-11-16(24)7-8-18(17)23(5)19(20)12-27-21-14(3)9-13(2)10-15(21)4/h7-11,24H,6,12H2,1-5H3
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n/an/a 700n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 5 to 10 mins by HPLC ana...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016513
PNG
(CHEMBL3260681)
Show SMILES CCOC(=O)c1c(CSc2c(Cl)cccc2Cl)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C19H17Cl2NO3S/c1-3-25-19(24)17-12-9-11(23)7-8-15(12)22(2)16(17)10-26-18-13(20)5-4-6-14(18)21/h4-9,23H,3,10H2,1-2H3
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n/an/a 800n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 5 to 10 mins by HPLC ana...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016514
PNG
(CHEMBL3260680)
Show SMILES CCOC(=O)c1c(CSc2c(C)cccc2C)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C21H23NO3S/c1-5-25-21(24)19-16-11-15(23)9-10-17(16)22(4)18(19)12-26-20-13(2)7-6-8-14(20)3/h6-11,23H,5,12H2,1-4H3
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n/an/a 800n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 5 to 10 mins by HPLC ana...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016519
PNG
(CHEMBL3260686)
Show SMILES CCOC(=O)c1c(CSc2ccccc2C(F)(F)F)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C20H18F3NO3S/c1-3-27-19(26)18-13-10-12(25)8-9-15(13)24(2)16(18)11-28-17-7-5-4-6-14(17)20(21,22)23/h4-10,25H,3,11H2,1-2H3
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n/an/a 800n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 5 to 10 mins by HPLC ana...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016513
PNG
(CHEMBL3260681)
Show SMILES CCOC(=O)c1c(CSc2c(Cl)cccc2Cl)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C19H17Cl2NO3S/c1-3-25-19(24)17-12-9-11(23)7-8-15(12)22(2)16(17)10-26-18-13(20)5-4-6-14(18)21/h4-9,23H,3,10H2,1-2H3
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n/an/a 900n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production from arachidonic acid preincubated for 15 mins by ...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016518
PNG
(CHEMBL3260687)
Show SMILES CCOC(=O)c1c(CSc2ccc(OC(F)(F)F)cc2)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C20H18F3NO4S/c1-3-27-19(26)18-15-10-12(25)4-9-16(15)24(2)17(18)11-29-14-7-5-13(6-8-14)28-20(21,22)23/h4-10,25H,3,11H2,1-2H3
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n/an/a 900n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 5 to 10 mins by HPLC ana...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016514
PNG
(CHEMBL3260680)
Show SMILES CCOC(=O)c1c(CSc2c(C)cccc2C)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C21H23NO3S/c1-5-25-21(24)19-16-11-15(23)9-10-17(16)22(4)18(19)12-26-20-13(2)7-6-8-14(20)3/h6-11,23H,5,12H2,1-4H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production from arachidonic acid preincubated for 15 mins by ...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016519
PNG
(CHEMBL3260686)
Show SMILES CCOC(=O)c1c(CSc2ccccc2C(F)(F)F)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C20H18F3NO3S/c1-3-27-19(26)18-13-10-12(25)8-9-15(13)24(2)16(18)11-28-17-7-5-4-6-14(17)20(21,22)23/h4-10,25H,3,11H2,1-2H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production from arachidonic acid preincubated for 15 mins by ...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016515
PNG
(CHEMBL3260690)
Show SMILES CCOC(=O)c1c(CSc2cc(C)cc(C)c2)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C21H23NO3S/c1-5-25-21(24)20-17-11-15(23)6-7-18(17)22(4)19(20)12-26-16-9-13(2)8-14(3)10-16/h6-11,23H,5,12H2,1-4H3
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n/an/a 1.80E+3n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 5 to 10 mins by HPLC ana...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016518
PNG
(CHEMBL3260687)
Show SMILES CCOC(=O)c1c(CSc2ccc(OC(F)(F)F)cc2)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C20H18F3NO4S/c1-3-27-19(26)18-15-10-12(25)4-9-16(15)24(2)17(18)11-29-14-7-5-13(6-8-14)28-20(21,22)23/h4-10,25H,3,11H2,1-2H3
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n/an/a 2.10E+3n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production from arachidonic acid preincubated for 15 mins by ...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016517
PNG
(CHEMBL3260688)
Show SMILES CCOC(=O)c1c(CSc2ccc(OC)cc2)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C20H21NO4S/c1-4-25-20(23)19-16-11-13(22)5-10-17(16)21(2)18(19)12-26-15-8-6-14(24-3)7-9-15/h5-11,22H,4,12H2,1-3H3
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n/an/a 2.30E+3n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 5 to 10 mins by HPLC ana...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016521
PNG
(CHEMBL1331577)
Show SMILES CCOC(=O)c1c(CSc2ccccc2)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C19H19NO3S/c1-3-23-19(22)18-15-11-13(21)9-10-16(15)20(2)17(18)12-24-14-7-5-4-6-8-14/h4-11,21H,3,12H2,1-2H3
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n/an/a 2.40E+3n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production from arachidonic acid preincubated for 15 mins by ...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM22332
PNG
(2-amino-5-hydroxyindole, 3n | ethyl 2-[(3-chloroph...)
Show SMILES CCOC(=O)c1c(Nc2cccc(Cl)c2)[nH]c2ccc(O)cc12
Show InChI InChI=1S/C17H15ClN2O3/c1-2-23-17(22)15-13-9-12(21)6-7-14(13)20-16(15)19-11-5-3-4-10(18)8-11/h3-9,19-21H,2H2,1H3
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n/an/a 2.40E+3n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production from arachidonic acid preincubated for 15 mins by ...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016515
PNG
(CHEMBL3260690)
Show SMILES CCOC(=O)c1c(CSc2cc(C)cc(C)c2)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C21H23NO3S/c1-5-25-21(24)20-17-11-15(23)6-7-18(17)22(4)19(20)12-26-16-9-13(2)8-14(3)10-16/h6-11,23H,5,12H2,1-4H3
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n/an/a 2.70E+3n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production from arachidonic acid preincubated for 15 mins by ...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016522
PNG
(CHEMBL3260689)
Show SMILES CCOC(=O)c1c(CSc2ccccc2OC)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C20H21NO4S/c1-4-25-20(23)19-14-11-13(22)9-10-15(14)21(2)16(19)12-26-18-8-6-5-7-17(18)24-3/h5-11,22H,4,12H2,1-3H3
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n/an/a 2.90E+3n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 5-LO expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 5 to 10 mins by HPLC ana...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50016517
PNG
(CHEMBL3260688)
Show SMILES CCOC(=O)c1c(CSc2ccc(OC)cc2)n(C)c2ccc(O)cc12
Show InChI InChI=1S/C20H21NO4S/c1-4-25-20(23)19-16-11-13(22)5-10-17(16)21(2)18(19)12-26-15-8-6-14(24-3)7-9-15/h5-11,22H,4,12H2,1-3H3
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n/an/a 3.10E+3n/an/an/an/an/an/a



University of Naples

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production from arachidonic acid preincubated for 15 mins by ...


Eur J Med Chem 81: 492-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.033
BindingDB Entry DOI: 10.7270/Q2TX3GXD
More data for this
Ligand-Target Pair
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