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Compile Data Set for Download or QSAR

Found 12 hits with Last Name = 'korde' and Initial = 'v'   
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
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381872
PNG
(CHEMBL2022883)
Show SMILES COc1ccc(cc1OC)-c1cc(=S)[nH]c(N)n1
Show InChI InChI=1S/C12H13N3O2S/c1-16-9-4-3-7(5-10(9)17-2)8-6-11(18)15-12(13)14-8/h3-6H,1-2H3,(H3,13,14,15,18)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM35440
PNG
(ALLOPURINOL | MLS000069453 | SMR000059083 | cid_20...)
Show SMILES O=c1[nH]cnc2n[nH]cc12
Show InChI InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)
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n/an/a 5.70E+3n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381870
PNG
(CHEMBL2022881)
Show SMILES COc1ccc(cc1)-c1cc(=O)[nH]c(N)n1
Show InChI InChI=1S/C11H11N3O2/c1-16-8-4-2-7(3-5-8)9-6-10(15)14-11(12)13-9/h2-6H,1H3,(H3,12,13,14,15)
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n/an/a 9.40E+3n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381871
PNG
(CHEMBL2022882)
Show SMILES COc1ccc(cc1OC)-c1cc(=O)[nH]c(N)n1
Show InChI InChI=1S/C12H13N3O3/c1-17-9-4-3-7(5-10(9)18-2)8-6-11(16)15-12(13)14-8/h3-6H,1-2H3,(H3,13,14,15,16)
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n/an/a 3.03E+4n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381866
PNG
(CHEMBL2023703)
Show SMILES COc1ccc(cc1)-c1cc(OC)nc(N)n1
Show InChI InChI=1S/C12H13N3O2/c1-16-9-5-3-8(4-6-9)10-7-11(17-2)15-12(13)14-10/h3-7H,1-2H3,(H2,13,14,15)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381868
PNG
(CHEMBL1441502)
Show SMILES COc1ccc(cc1)-c1cc(nc(NN)n1)C#N
Show InChI InChI=1S/C12H11N5O/c1-18-10-4-2-8(3-5-10)11-6-9(7-13)15-12(16-11)17-14/h2-6H,14H2,1H3,(H,15,16,17)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381869
PNG
(CHEMBL1606931)
Show SMILES COc1ccc(cc1)-c1cc(nc(N)n1)C(F)(F)F
Show InChI InChI=1S/C12H10F3N3O/c1-19-8-4-2-7(3-5-8)9-6-10(12(13,14)15)18-11(16)17-9/h2-6H,1H3,(H2,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381865
PNG
(CHEMBL2023701)
Show SMILES COc1ccc(cc1)-c1cc(N)nc(N)n1
Show InChI InChI=1S/C11H12N4O/c1-16-8-4-2-7(3-5-8)9-6-10(12)15-11(13)14-9/h2-6H,1H3,(H4,12,13,14,15)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381864
PNG
(CHEMBL2023700)
Show SMILES COc1ccc(cc1)-c1cc(Cl)nc(Cl)n1
Show InChI InChI=1S/C11H8Cl2N2O/c1-16-8-4-2-7(3-5-8)9-6-10(12)15-11(13)14-9/h2-6H,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381863
PNG
(CHEMBL1724082)
Show SMILES COc1ccc(cc1)-c1cc(=O)[nH]c(=O)[nH]1
Show InChI InChI=1S/C11H10N2O3/c1-16-8-4-2-7(3-5-8)9-6-10(14)13-11(15)12-9/h2-6H,1H3,(H2,12,13,14,15)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381862
PNG
(CHEMBL2023702)
Show SMILES COc1ccc(cc1)-c1cc(NS(C)(=O)=O)nc(N)n1
Show InChI InChI=1S/C12H14N4O3S/c1-19-9-5-3-8(4-6-9)10-7-11(15-12(13)14-10)16-20(2,17)18/h3-7H,1-2H3,(H3,13,14,15,16)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50381867
PNG
(CHEMBL2023704)
Show SMILES COc1ccc(cc1)-c1ccnc(N)n1
Show InChI InChI=1S/C11H11N3O/c1-15-9-4-2-8(3-5-9)10-6-7-13-11(12)14-10/h2-7H,1H3,(H2,12,13,14)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Piramal Healthcare Limited

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase assessed as uric acid formation using xanthine as substrate after 30 mins by spectrophotometric analysis


Bioorg Med Chem 20: 2930-9 (2012)


Article DOI: 10.1016/j.bmc.2012.03.019
BindingDB Entry DOI: 10.7270/Q2Z320NM
More data for this
Ligand-Target Pair