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PubMed code 27492194

Compile data set for download or QSAR
Found 30 hits of Enzyme Inhibition Constant Data   
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
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534504
PNG
(CHEMBL4590676)
Show SMILES ONC(=O)CC(O)c1cc(Cl)ccc1OCc1ccccc1
Show InChI InChI=1S/C16H16ClNO4/c17-12-6-7-15(22-10-11-4-2-1-3-5-11)13(8-12)14(19)9-16(20)18-21/h1-8,14,19,21H,9-10H2,(H,18,20)
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372n/an/an/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as inhibition constant for enzyme-urea-inhibitor complex by non-linear fitt...


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534504
PNG
(CHEMBL4590676)
Show SMILES ONC(=O)CC(O)c1cc(Cl)ccc1OCc1ccccc1
Show InChI InChI=1S/C16H16ClNO4/c17-12-6-7-15(22-10-11-4-2-1-3-5-11)13(8-12)14(19)9-16(20)18-21/h1-8,14,19,21H,9-10H2,(H,18,20)
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404n/an/an/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as inhibition constant for enzyme-inhibitor complex by non-linear fitting a...


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50493364
PNG
(CHEMBL2425480)
Show SMILES ONC(=O)CC(O)c1cc(Cl)ccc1O
Show InChI InChI=1S/C9H10ClNO4/c10-5-1-2-7(12)6(3-5)8(13)4-9(14)11-15/h1-3,8,12-13,15H,4H2,(H,11,14)
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1.20E+3n/an/an/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as inhibition constant for enzyme-urea-inhibitor complex by non-linear fitt...


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50493364
PNG
(CHEMBL2425480)
Show SMILES ONC(=O)CC(O)c1cc(Cl)ccc1O
Show InChI InChI=1S/C9H10ClNO4/c10-5-1-2-7(12)6(3-5)8(13)4-9(14)11-15/h1-3,8,12-13,15H,4H2,(H,11,14)
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4.74E+3n/an/an/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as inhibition constant for enzyme-inhibitor complex by non-linear fitting a...


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM24961
PNG
(Urea)
Show SMILES NC(N)=O
Show InChI InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)
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6.47E+6n/an/an/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Substrate inhibition of Helicobacter pylori urease in presence of >4 mM urea by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534504
PNG
(CHEMBL4590676)
Show SMILES ONC(=O)CC(O)c1cc(Cl)ccc1OCc1ccccc1
Show InChI InChI=1S/C16H16ClNO4/c17-12-6-7-15(22-10-11-4-2-1-3-5-11)13(8-12)14(19)9-16(20)18-21/h1-8,14,19,21H,9-10H2,(H,18,20)
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n/an/a 150n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50493364
PNG
(CHEMBL2425480)
Show SMILES ONC(=O)CC(O)c1cc(Cl)ccc1O
Show InChI InChI=1S/C9H10ClNO4/c10-5-1-2-7(12)6(3-5)8(13)4-9(14)11-15/h1-3,8,12-13,15H,4H2,(H,11,14)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534516
PNG
(CHEMBL4545901)
Show SMILES ONC(=O)CC(O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C9H9Cl2NO3/c10-5-1-2-6(7(11)3-5)8(13)4-9(14)12-15/h1-3,8,13,15H,4H2,(H,12,14)
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n/an/a 1.34E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50099857
PNG
(ACETOHYDROXAMIC ACID (AHA) | AHA | Acethydroxamsae...)
Show SMILES CC(=O)NO
Show InChI InChI=1S/C2H5NO2/c1-2(4)3-5/h5H,1H3,(H,3,4)
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n/an/a 2.38E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534505
PNG
(CHEMBL4568283)
Show SMILES CN(O)C(=O)CC(O)c1cc(Cl)ccc1OCc1ccccc1
Show InChI InChI=1S/C17H18ClNO4/c1-19(22)17(21)10-15(20)14-9-13(18)7-8-16(14)23-11-12-5-3-2-4-6-12/h2-9,15,20,22H,10-11H2,1H3
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n/an/a 2.62E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534506
PNG
(CHEMBL4469655)
Show SMILES CN(O)C(=O)CC(O)c1cc(Cl)ccc1O
Show InChI InChI=1S/C10H12ClNO4/c1-12(16)10(15)5-9(14)7-4-6(11)2-3-8(7)13/h2-4,9,13-14,16H,5H2,1H3
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n/an/a 3.05E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534501
PNG
(CHEMBL4516908)
Show SMILES CN(O)C(=O)CC(O)c1cccc(Cl)c1
Show InChI InChI=1S/C10H12ClNO3/c1-12(15)10(14)6-9(13)7-3-2-4-8(11)5-7/h2-5,9,13,15H,6H2,1H3
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n/an/a 4.80E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534503
PNG
(CHEMBL4555761)
Show SMILES CN(O)C(=O)CC(O)c1ccccc1Cl
Show InChI InChI=1S/C10H12ClNO3/c1-12(15)10(14)6-9(13)7-4-2-3-5-8(7)11/h2-5,9,13,15H,6H2,1H3
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n/an/a 5.66E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534518
PNG
(CHEMBL4585313)
Show SMILES CN(O)C(=O)CC(O)c1cccc(F)c1
Show InChI InChI=1S/C10H12FNO3/c1-12(15)10(14)6-9(13)7-3-2-4-8(11)5-7/h2-5,9,13,15H,6H2,1H3
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n/an/a 7.12E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534512
PNG
(CHEMBL4439781)
Show SMILES CN(O)C(=O)CC(O)c1ccc(F)cc1
Show InChI InChI=1S/C10H12FNO3/c1-12(15)10(14)6-9(13)7-2-4-8(11)5-3-7/h2-5,9,13,15H,6H2,1H3
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n/an/a 7.72E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534509
PNG
(CHEMBL4579243)
Show SMILES CN(O)C(=O)CC(O)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C10H11Cl2NO3/c1-13(16)9(15)5-8(14)10-6(11)3-2-4-7(10)12/h2-4,8,14,16H,5H2,1H3
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n/an/a 7.79E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534500
PNG
(CHEMBL4470787)
Show SMILES CN(O)C(=O)CC(O)c1cccc(Br)c1
Show InChI InChI=1S/C10H12BrNO3/c1-12(15)10(14)6-9(13)7-3-2-4-8(11)5-7/h2-5,9,13,15H,6H2,1H3
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n/an/a 7.82E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534502
PNG
(CHEMBL4539763)
Show SMILES COc1ccccc1C(O)CC(=O)N(C)O
Show InChI InChI=1S/C11H15NO4/c1-12(15)11(14)7-9(13)8-5-3-4-6-10(8)16-2/h3-6,9,13,15H,7H2,1-2H3
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n/an/a 8.40E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534520
PNG
(CHEMBL4473012)
Show SMILES CN(O)C(=O)CC(O)c1ccc(Cl)cc1
Show InChI InChI=1S/C10H12ClNO3/c1-12(15)10(14)6-9(13)7-2-4-8(11)5-3-7/h2-5,9,13,15H,6H2,1H3
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n/an/a 8.74E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534514
PNG
(CHEMBL4535418)
Show SMILES COc1cccc(c1)C(O)CC(=O)N(C)O
Show InChI InChI=1S/C11H15NO4/c1-12(15)11(14)7-10(13)8-4-3-5-9(6-8)16-2/h3-6,10,13,15H,7H2,1-2H3
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n/an/a 8.92E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534508
PNG
(CHEMBL4530689)
Show SMILES CN(O)C(=O)CC(O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C10H11Cl2NO3/c1-13(16)10(15)5-9(14)6-2-3-7(11)8(12)4-6/h2-4,9,14,16H,5H2,1H3
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n/an/a 9.04E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534521
PNG
(CHEMBL4440368)
Show SMILES CN(O)C(=O)CC(O)c1cccc(Cl)c1Cl
Show InChI InChI=1S/C10H11Cl2NO3/c1-13(16)9(15)5-8(14)6-3-2-4-7(11)10(6)12/h2-4,8,14,16H,5H2,1H3
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n/an/a 9.58E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534517
PNG
(CHEMBL4461397)
Show SMILES CN(O)C(=O)CC(O)c1ccc(Br)cc1
Show InChI InChI=1S/C10H12BrNO3/c1-12(15)10(14)6-9(13)7-2-4-8(11)5-3-7/h2-5,9,13,15H,6H2,1H3
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n/an/a 9.76E+4n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534510
PNG
(CHEMBL4534392)
Show SMILES CN(O)C(=O)CC(O)c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C17H19NO4/c1-18(21)17(20)11-16(19)14-7-9-15(10-8-14)22-12-13-5-3-2-4-6-13/h2-10,16,19,21H,11-12H2,1H3
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n/an/a 1.98E+5n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534515
PNG
(CHEMBL4476469)
Show SMILES COc1cc(ccc1OCc1ccccc1)C(O)CC(=O)N(C)O
Show InChI InChI=1S/C18H21NO5/c1-19(22)18(21)11-15(20)14-8-9-16(17(10-14)23-2)24-12-13-6-4-3-5-7-13/h3-10,15,20,22H,11-12H2,1-2H3
PDB

UniProtKB/SwissProt

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UniChem
Article
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n/an/a 2.58E+5n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534519
PNG
(CHEMBL4437504)
Show SMILES CN(C)c1ccc(cc1)C(O)CC(=O)N(C)O
Show InChI InChI=1S/C12H18N2O3/c1-13(2)10-6-4-9(5-7-10)11(15)8-12(16)14(3)17/h4-7,11,15,17H,8H2,1-3H3
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n/an/a 2.87E+5n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534511
PNG
(CHEMBL4454777)
Show SMILES COc1ccc(cc1)C(O)CC(=O)N(C)O
Show InChI InChI=1S/C11H15NO4/c1-12(15)11(14)7-10(13)8-3-5-9(16-2)6-4-8/h3-6,10,13,15H,7H2,1-2H3
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UniProtKB/SwissProt

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n/an/a 3.28E+5n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534499
PNG
(CHEMBL4472402)
Show SMILES CN(O)C(=O)CC(O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C10H11Cl2NO3/c1-13(16)10(15)5-9(14)7-3-2-6(11)4-8(7)12/h2-4,9,14,16H,5H2,1H3
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n/an/a 3.67E+5n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534507
PNG
(CHEMBL4531553)
Show SMILES CN(O)C(=O)CC(O)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
Show InChI InChI=1S/C24H25NO5/c1-25(28)24(27)15-21(26)20-12-13-22(29-16-18-8-4-2-5-9-18)23(14-20)30-17-19-10-6-3-7-11-19/h2-14,21,26,28H,15-17H2,1H3
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UniProtKB/SwissProt

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n/an/a 3.76E+5n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
Urease subunit beta


(Helicobacter pylori (strain ATCC 700392 / 26695) (...)
BDBM50534513
PNG
(CHEMBL4447735)
Show SMILES COc1ccc(cc1OC)C(O)CC(=O)N(C)O
Show InChI InChI=1S/C12H17NO5/c1-13(16)12(15)7-9(14)8-4-5-10(17-2)11(6-8)18-3/h4-6,9,14,16H,7H2,1-3H3
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UniProtKB/SwissProt

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UniChem
Article
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n/an/a 4.05E+5n/an/an/an/an/an/a



Jishou University

Curated by ChEMBL


Assay Description
Inhibition of Helicobacter pylori urease using urea as substrate assessed as ammonia production after 50 mins by indophenol method


Bioorg Med Chem 24: 4519-4527 (2016)


Article DOI: 10.1016/j.bmc.2016.07.052
BindingDB Entry DOI: 10.7270/Q24F1V76
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%