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Compile Data Set for Download or QSAR

Found 49 hits with Last Name = 'rodriguez' and Initial = 'n'   
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
Polyphenol oxidase 2


(Agaricus bisporus (Common mushroom))
BDBM50187502
PNG
(4-Ethylresorcinol | CHEMBL2332776)
Show SMILES CCc1ccc(O)cc1O
Show InChI InChI=1S/C8H10O2/c1-2-6-3-4-7(9)5-8(6)10/h3-5,9-10H,2H2,1H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



University of Murcia

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-dopa as substrate assessed as diphenolase activity by spectrophotometric analysis


Bioorg Med Chem 24: 4434-4443 (2016)


Article DOI: 10.1016/j.bmc.2016.07.048
BindingDB Entry DOI: 10.7270/Q24F1SP6
More data for this
Ligand-Target Pair
Polyphenol oxidase 2


(Agaricus bisporus (Common mushroom))
BDBM50187502
PNG
(4-Ethylresorcinol | CHEMBL2332776)
Show SMILES CCc1ccc(O)cc1O
Show InChI InChI=1S/C8H10O2/c1-2-6-3-4-7(9)5-8(6)10/h3-5,9-10H,2H2,1H3
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n/an/a 1.90E+3n/an/an/an/an/an/a



University of Murcia

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-tyrosine as substrate assessed as monophenolase activity by spectrophotometric analysis


Bioorg Med Chem 24: 4434-4443 (2016)


Article DOI: 10.1016/j.bmc.2016.07.048
BindingDB Entry DOI: 10.7270/Q24F1SP6
More data for this
Ligand-Target Pair
Polyphenol oxidase 2


(Agaricus bisporus (Common mushroom))
BDBM50187504
PNG
(CHEMBL3828450)
Show SMILES Cc1ccc(O)cc1O
Show InChI InChI=1S/C7H8O2/c1-5-2-3-6(8)4-7(5)9/h2-4,8-9H,1H3
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n/an/a 3.30E+3n/an/an/an/an/an/a



University of Murcia

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-dopa as substrate assessed as diphenolase activity by spectrophotometric analysis


Bioorg Med Chem 24: 4434-4443 (2016)


Article DOI: 10.1016/j.bmc.2016.07.048
BindingDB Entry DOI: 10.7270/Q24F1SP6
More data for this
Ligand-Target Pair
Polyphenol oxidase 2


(Agaricus bisporus (Common mushroom))
BDBM50187504
PNG
(CHEMBL3828450)
Show SMILES Cc1ccc(O)cc1O
Show InChI InChI=1S/C7H8O2/c1-5-2-3-6(8)4-7(5)9/h2-4,8-9H,1H3
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n/an/a 9.31E+3n/an/an/an/an/an/a



University of Murcia

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-tyrosine as substrate assessed as monophenolase activity by spectrophotometric analysis


Bioorg Med Chem 24: 4434-4443 (2016)


Article DOI: 10.1016/j.bmc.2016.07.048
BindingDB Entry DOI: 10.7270/Q24F1SP6
More data for this
Ligand-Target Pair
Polyphenol oxidase 2


(Agaricus bisporus (Common mushroom))
BDBM26189
PNG
(α-CA inhibitor, 13 | 1,3-Dihydroxybenzene, XI...)
Show SMILES Oc1cccc(O)c1
Show InChI InChI=1S/C6H6O2/c7-5-2-1-3-6(8)4-5/h1-4,7-8H
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n/an/a 6.52E+5n/an/an/an/an/an/a



University of Murcia

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-dopa as substrate assessed as diphenolase activity by spectrophotometric analysis


Bioorg Med Chem 24: 4434-4443 (2016)


Article DOI: 10.1016/j.bmc.2016.07.048
BindingDB Entry DOI: 10.7270/Q24F1SP6
More data for this
Ligand-Target Pair
Polyphenol oxidase 2


(Agaricus bisporus (Common mushroom))
BDBM50187503
PNG
(2-Methylresorcinol | CHEMBL2332773)
Show SMILES Cc1c(O)cccc1O
Show InChI InChI=1S/C7H8O2/c1-5-6(8)3-2-4-7(5)9/h2-4,8-9H,1H3
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n/an/a 7.17E+5n/an/an/an/an/an/a



University of Murcia

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-dopa as substrate assessed as diphenolase activity by spectrophotometric analysis


Bioorg Med Chem 24: 4434-4443 (2016)


Article DOI: 10.1016/j.bmc.2016.07.048
BindingDB Entry DOI: 10.7270/Q24F1SP6
More data for this
Ligand-Target Pair
Polyphenol oxidase 2


(Agaricus bisporus (Common mushroom))
BDBM26189
PNG
(α-CA inhibitor, 13 | 1,3-Dihydroxybenzene, XI...)
Show SMILES Oc1cccc(O)c1
Show InChI InChI=1S/C6H6O2/c7-5-2-1-3-6(8)4-5/h1-4,7-8H
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n/an/a 1.13E+6n/an/an/an/an/an/a



University of Murcia

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-tyrosine as substrate assessed as monophenolase activity by spectrophotometric analysis


Bioorg Med Chem 24: 4434-4443 (2016)


Article DOI: 10.1016/j.bmc.2016.07.048
BindingDB Entry DOI: 10.7270/Q24F1SP6
More data for this
Ligand-Target Pair
Polyphenol oxidase 2


(Agaricus bisporus (Common mushroom))
BDBM50187503
PNG
(2-Methylresorcinol | CHEMBL2332773)
Show SMILES Cc1c(O)cccc1O
Show InChI InChI=1S/C7H8O2/c1-5-6(8)3-2-4-7(5)9/h2-4,8-9H,1H3
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n/an/a 1.42E+6n/an/an/an/an/an/a



University of Murcia

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-tyrosine as substrate assessed as monophenolase activity by spectrophotometric analysis


Bioorg Med Chem 24: 4434-4443 (2016)


Article DOI: 10.1016/j.bmc.2016.07.048
BindingDB Entry DOI: 10.7270/Q24F1SP6
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216528
PNG
(6-phenyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole-3...)
Show SMILES OC(=O)c1n[nH]c2C(CCc12)c1ccccc1
Show InChI InChI=1S/C13H12N2O2/c16-13(17)12-10-7-6-9(11(10)14-15-12)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,14,15)(H,16,17)
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n/an/an/an/a 1.20E+4n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216529
PNG
(6-methyl-4,6-dihydro-2H-furo[3,4-c]pyrazole-3-carb...)
Show SMILES CC1OCc2c1n[nH]c2C(O)=O
Show InChI InChI=1S/C7H8N2O3/c1-3-5-4(2-12-3)6(7(10)11)9-8-5/h3H,2H2,1H3,(H,8,9)(H,10,11)
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n/an/an/an/a 2.50E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216530
PNG
(4,6-dihydro-2H-thieno[3,4-c]pyrazole-3-carboxylic ...)
Show SMILES OC(=O)c1[nH]nc2CSCc12
Show InChI InChI=1S/C6H6N2O2S/c9-6(10)5-3-1-11-2-4(3)7-8-5/h1-2H2,(H,7,8)(H,9,10)
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n/an/an/an/a 5.60E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216531
PNG
(5-bromonicotinic acid | CHEMBL247336)
Show SMILES OC(=O)c1cncc(Br)c1
Show InChI InChI=1S/C6H4BrNO2/c7-5-1-4(6(9)10)2-8-3-5/h1-3H,(H,9,10)
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n/an/an/an/a 1.36E+4n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216532
PNG
(CHEMBL393226 | isothiazole-4-carboxylic acid)
Show SMILES OC(=O)c1cnsc1
Show InChI InChI=1S/C4H3NO2S/c6-4(7)3-1-5-8-2-3/h1-2H,(H,6,7)
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n/an/an/an/a 1.50E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50132135
PNG
(4,6-Dihydro-1H-furo[3,4-c]pyrazole-3-carboxylic ac...)
Show SMILES OC(=O)c1[nH]nc2COCc12
Show InChI InChI=1S/C6H6N2O3/c9-6(10)5-3-1-11-2-4(3)7-8-5/h1-2H2,(H,7,8)(H,9,10)
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n/an/an/an/a 2.70E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216533
PNG
(3-cyclopropyl-1H-pyrazole-5-carboxylic acid | 5-cy...)
Show SMILES OC(=O)c1cc([nH]n1)C1CC1
Show InChI InChI=1S/C7H8N2O2/c10-7(11)6-3-5(8-9-6)4-1-2-4/h3-4H,1-2H2,(H,8,9)(H,10,11)
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n/an/an/an/a 1.00E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216535
PNG
(3-(hydroxymethyl)-1H-pyrazole-5-carboxylic acid | ...)
Show SMILES OCc1cc([nH]n1)C(O)=O
Show InChI InChI=1S/C5H6N2O3/c8-2-3-1-4(5(9)10)7-6-3/h1,8H,2H2,(H,6,7)(H,9,10)
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n/an/an/an/a 2.50E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216534
PNG
(5-methylnicotinic acid | CHEMBL247132)
Show SMILES Cc1cncc(c1)C(O)=O
Show InChI InChI=1S/C7H7NO2/c1-5-2-6(7(9)10)4-8-3-5/h2-4H,1H3,(H,9,10)
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n/an/an/an/a 1.60E+4n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216536
PNG
(6-propyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole-3...)
Show SMILES CCCC1CCc2c(n[nH]c12)C(O)=O
Show InChI InChI=1S/C10H14N2O2/c1-2-3-6-4-5-7-8(6)11-12-9(7)10(13)14/h6H,2-5H2,1H3,(H,11,12)(H,13,14)
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n/an/an/an/a 6.60E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216537
PNG
(3-benzyl-1H-pyrazole-5-carboxylic acid | 5-Benzyl-...)
Show SMILES OC(=O)c1cc(Cc2ccccc2)[nH]n1
Show InChI InChI=1S/C11H10N2O2/c14-11(15)10-7-9(12-13-10)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,12,13)(H,14,15)
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n/an/an/an/a 8.90E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216540
PNG
(3-(methylsulfinylmethyl)-1H-pyrazole-5-carboxylic ...)
Show SMILES CS(=O)Cc1cc(n[nH]1)C(O)=O
Show InChI InChI=1S/C6H8N2O3S/c1-12(11)3-4-2-5(6(9)10)8-7-4/h2H,3H2,1H3,(H,7,8)(H,9,10)
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n/an/an/an/a 4.90E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216539
PNG
(3-ethyl-1H-pyrazole-5-carboxylic acid | 5-ethyl-1H...)
Show SMILES CCc1cc(n[nH]1)C(O)=O
Show InChI InChI=1S/C6H8N2O2/c1-2-4-3-5(6(9)10)8-7-4/h3H,2H2,1H3,(H,7,8)(H,9,10)
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n/an/an/an/a 800n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216538
PNG
(3-hexyl-1H-pyrazole-5-carboxylic acid | CHEMBL2479...)
Show SMILES CCCCCCc1cc(n[nH]1)C(O)=O
Show InChI InChI=1S/C10H16N2O2/c1-2-3-4-5-6-8-7-9(10(13)14)12-11-8/h7H,2-6H2,1H3,(H,11,12)(H,13,14)
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n/an/an/an/a 5.60E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216541
PNG
(CHEMBL613 | POA | PYRAZINOIC ACID | PZA | Rifater ...)
Show SMILES OC(=O)c1cnccn1
Show InChI InChI=1S/C5H4N2O2/c8-5(9)4-3-6-1-2-7-4/h1-3H,(H,8,9)
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n/an/an/an/a 6.30E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50211363
PNG
(3-isopropyl-1H-pyrazole-5-carboxylic acid | 5-Isop...)
Show SMILES CC(C)c1cc(n[nH]1)C(O)=O
Show InChI InChI=1S/C7H10N2O2/c1-4(2)5-3-6(7(10)11)9-8-5/h3-4H,1-2H3,(H,8,9)(H,10,11)
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n/an/an/an/a 8.30E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216546
PNG
(5-chloronicotinic acid | CHEMBL395178)
Show SMILES OC(=O)c1cncc(Cl)c1
Show InChI InChI=1S/C6H4ClNO2/c7-5-1-4(6(9)10)2-8-3-5/h1-3H,(H,9,10)
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n/an/an/an/a 7.60E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50220850
PNG
(3-propyl-1H-pyrazole-5-carboxylic acid | 5-propyl-...)
Show SMILES CCCc1cc(n[nH]1)C(O)=O
Show InChI InChI=1S/C7H10N2O2/c1-2-3-5-4-6(7(10)11)9-8-5/h4H,2-3H2,1H3,(H,8,9)(H,10,11)
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n/an/an/an/a 3.90E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216544
PNG
(3-(2-methoxyethyl)-1H-pyrazole-5-carboxylic acid |...)
Show SMILES COCCc1cc(n[nH]1)C(O)=O
Show InChI InChI=1S/C7H10N2O3/c1-12-3-2-5-4-6(7(10)11)9-8-5/h4H,2-3H2,1H3,(H,8,9)(H,10,11)
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n/an/an/an/a 1.22E+4n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216543
PNG
(3-formyl-1H-pyrazole-5-carboxylic acid | CHEMBL246...)
Show SMILES OC(=O)c1cc(C=O)[nH]n1
Show InChI InChI=1S/C5H4N2O3/c8-2-3-1-4(5(9)10)7-6-3/h1-2H,(H,6,7)(H,9,10)
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n/an/an/an/a 6.10E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50211364
PNG
(3-(3-fluorobenzyl)-1H-pyrazole-5-carboxylic acid |...)
Show SMILES OC(=O)c1cc(Cc2cccc(F)c2)[nH]n1
Show InChI InChI=1S/C11H9FN2O2/c12-8-3-1-2-7(4-8)5-9-6-10(11(15)16)14-13-9/h1-4,6H,5H2,(H,13,14)(H,15,16)
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n/an/an/an/a 2.80E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50211365
PNG
(3-(3-bromobenzyl)-1H-pyrazole-5-carboxylic acid | ...)
Show SMILES OC(=O)c1cc(Cc2cccc(Br)c2)[nH]n1
Show InChI InChI=1S/C11H9BrN2O2/c12-8-3-1-2-7(4-8)5-9-6-10(11(15)16)14-13-9/h1-4,6H,5H2,(H,13,14)(H,15,16)
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n/an/an/an/a 1.05E+4n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216552
PNG
(2-methylthiazole-5-carboxylic acid | CHEMBL247134)
Show SMILES Cc1ncc(s1)C(O)=O
Show InChI InChI=1S/C5H5NO2S/c1-3-6-2-4(9-3)5(7)8/h2H,1H3,(H,7,8)
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n/an/an/an/a 500n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216548
PNG
(6-ethyl-4,6-dihydro-2H-furo[3,4-c]pyrazole-3-carbo...)
Show SMILES CCC1OCc2c1n[nH]c2C(O)=O
Show InChI InChI=1S/C8H10N2O3/c1-2-5-6-4(3-13-5)7(8(11)12)10-9-6/h5H,2-3H2,1H3,(H,9,10)(H,11,12)
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n/an/an/an/a 8.70E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216550
PNG
(3-(3-chlorobenzyl)-1H-pyrazole-5-carboxylic acid |...)
Show SMILES OC(=O)c1cc(Cc2cccc(Cl)c2)[nH]n1
Show InChI InChI=1S/C11H9ClN2O2/c12-8-3-1-2-7(4-8)5-9-6-10(11(15)16)14-13-9/h1-4,6H,5H2,(H,13,14)(H,15,16)
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n/an/an/an/a 6.20E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216551
PNG
(3-pentyl-1H-pyrazole-5-carboxylic acid | 5-butylpy...)
Show SMILES CCCCCc1cc(n[nH]1)C(O)=O
Show InChI InChI=1S/C9H14N2O2/c1-2-3-4-5-7-6-8(9(12)13)11-10-7/h6H,2-5H2,1H3,(H,10,11)(H,12,13)
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n/an/an/an/a 1.80E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM23515
PNG
(CHEMBL573 | Niacin | Nicotinic Acid | [5, 6-3H]-ni...)
Show SMILES OC(=O)c1cccnc1
Show InChI InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
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n/an/an/an/a 120n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50211362
PNG
(5-methyl-1H-pyrazole-3-carboxylic acid | 5-methyl-...)
Show SMILES Cc1cc(n[nH]1)C(O)=O
Show InChI InChI=1S/C5H6N2O2/c1-3-2-4(5(8)9)7-6-3/h2H,1H3,(H,6,7)(H,8,9)
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n/an/an/an/a 460n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50132140
PNG
(1,4,5,6-Tetrahydro-cyclopentapyrazole-3-carboxylic...)
Show SMILES OC(=O)c1n[nH]c2CCCc12
Show InChI InChI=1S/C7H8N2O2/c10-7(11)6-4-2-1-3-5(4)8-9-6/h1-3H2,(H,8,9)(H,10,11)
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n/an/an/an/a 860n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216542
PNG
(CHEMBL394068 | pyridazine-4-carboxylic acid)
Show SMILES OC(=O)c1ccnnc1
Show InChI InChI=1S/C5H4N2O2/c8-5(9)4-1-2-6-7-3-4/h1-3H,(H,8,9)
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n/an/an/an/a 2.30E+4n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216547
PNG
(3-(methylthiomethyl)-1H-pyrazole-5-carboxylic acid...)
Show SMILES CSCc1cc([nH]n1)C(O)=O
Show InChI InChI=1S/C6H8N2O2S/c1-11-3-4-2-5(6(9)10)8-7-4/h2H,3H2,1H3,(H,7,8)(H,9,10)
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n/an/an/an/a 3.70E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50211361
PNG
(3-methyl-5-carboxyl-isoxazole | 3-methylisoxazole-...)
Show SMILES Cc1cc(on1)C(O)=O
Show InChI InChI=1S/C5H5NO3/c1-3-2-4(5(7)8)9-6-3/h2H,1H3,(H,7,8)
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n/an/an/an/a 1.30E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216526
PNG
(3-(methoxymethyl)-1H-pyrazole-5-carboxylic acid | ...)
Show SMILES COCc1cc([nH]n1)C(O)=O
Show InChI InChI=1S/C6H8N2O3/c1-11-3-4-2-5(6(9)10)8-7-4/h2H,3H2,1H3,(H,7,8)(H,9,10)
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n/an/an/an/a 8.70E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216527
PNG
(5,6-dihydro-2H-thieno[3,2-c]pyrazole-3-carboxylic ...)
Show SMILES OC(=O)c1n[nH]c2CCSc12
Show InChI InChI=1S/C6H6N2O2S/c9-6(10)4-5-3(7-8-4)1-2-11-5/h1-2H2,(H,7,8)(H,9,10)
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n/an/an/an/a 2.20E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216525
PNG
(6-Methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3...)
Show SMILES CC1CCc2c1[nH]nc2C(O)=O
Show InChI InChI=1S/C8H10N2O2/c1-4-2-3-5-6(4)9-10-7(5)8(11)12/h4H,2-3H2,1H3,(H,9,10)(H,11,12)
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n/an/an/an/a 8.30E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216524
PNG
(3-cyclobutyl-1H-pyrazole-5-carboxylic acid | 5-cyc...)
Show SMILES OC(=O)c1cc([nH]n1)C1CCC1
Show InChI InChI=1S/C8H10N2O2/c11-8(12)7-4-6(9-10-7)5-2-1-3-5/h4-5H,1-3H2,(H,9,10)(H,11,12)
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n/an/an/an/a 1.62E+4n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216523
PNG
(6-propyl-4,6-dihydro-2H-furo[3,4-c]pyrazole-3-carb...)
Show SMILES CCCC1OCc2c1n[nH]c2C(O)=O
Show InChI InChI=1S/C9H12N2O3/c1-2-3-6-7-5(4-14-6)8(9(12)13)11-10-7/h6H,2-4H2,1H3,(H,10,11)(H,12,13)
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n/an/an/an/a 2.10E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216522
PNG
(1-methyl-1H-pyrazole-4-carboxylic acid | CHEMBL393...)
Show SMILES Cn1cc(cn1)C(O)=O
Show InChI InChI=1S/C5H6N2O2/c1-7-3-4(2-6-7)5(8)9/h2-3H,1H3,(H,8,9)
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n/an/an/an/a>2.00E+4n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216521
PNG
(5-fluoronicotinic acid | CHEMBL397783)
Show SMILES OC(=O)c1cncc(F)c1
Show InChI InChI=1S/C6H4FNO2/c7-5-1-4(6(9)10)2-8-3-5/h1-3H,(H,9,10)
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n/an/an/an/a 5.30E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50220842
PNG
(3-butyl-1H-pyrazole-5-carboxylic acid | 5-butyl-1H...)
Show SMILES CCCCc1cc(n[nH]1)C(O)=O
Show InChI InChI=1S/C8H12N2O2/c1-2-3-4-6-5-7(8(11)12)10-9-6/h5H,2-4H2,1H3,(H,9,10)(H,11,12)
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PDB
Article
PubMed
n/an/an/an/a 1.40E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50216520
PNG
(CHEMBL247316 | pyrimidine-5-carboxylic acid)
Show SMILES OC(=O)c1cncnc1
Show InChI InChI=1S/C5H4N2O2/c8-5(9)4-1-6-3-7-2-4/h1-3H,(H,8,9)
PDB

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Article
PubMed
n/an/an/an/a 2.90E+3n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP production test


Bioorg Med Chem Lett 17: 4914-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.028
BindingDB Entry DOI: 10.7270/Q2NP244M
More data for this
Ligand-Target Pair