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Found 1110 hits Enz. Inhib. hit(s) with Target = 'Urease'   
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


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246417
PNG
(US9447057, 1)
Show SMILES C1C=Cc2ccc3cc(\C=N\c4nc(cs4)-c4ccccc4)cc4CC=C1c2c34 |c:1,t:27|
Show InChI InChI=1S/C26H18N2S/c1-2-5-18(6-3-1)23-16-29-26(28-23)27-15-17-13-21-11-9-19-7-4-8-20-10-12-22(14-17)25(21)24(19)20/h1-7,9-11,13-16H,8,12H2/b27-15+
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3.82E+3n/a 2.80E+3n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246422
PNG
(US9447057, 8)
Show SMILES Oc1ccc(Cl)cc1\C=N\c1nc(cs1)-c1ccccc1
Show InChI InChI=1S/C16H11ClN2OS/c17-13-6-7-15(20)12(8-13)9-18-16-19-14(10-21-16)11-4-2-1-3-5-11/h1-10,20H/b18-9+
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7.89E+3n/a 8.13E+3n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246420
PNG
(US9447057, 6)
Show SMILES COc1cccc(\C=N\c2nc(cs2)-c2ccccc2)c1O
Show InChI InChI=1S/C17H14N2O2S/c1-21-15-9-5-8-13(16(15)20)10-18-17-19-14(11-22-17)12-6-3-2-4-7-12/h2-11,20H,1H3/b18-10+
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8.22E+3n/a 8.80E+3n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246418
PNG
(US9447057, 4)
Show SMILES CCOc1ccc(\C=N\c2nc(cs2)-c2ccccc2)cc1
Show InChI InChI=1S/C18H16N2OS/c1-2-21-16-10-8-14(9-11-16)12-19-18-20-17(13-22-18)15-6-4-3-5-7-15/h3-13H,2H2,1H3/b19-12+
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9.23E+3n/a 1.12E+4n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246442
PNG
(US9447057, 2)
Show SMILES C(=N/c1nc(cs1)-c1ccccc1)\c1c[nH]c2ccccc12
Show InChI InChI=1S/C18H13N3S/c1-2-6-13(7-3-1)17-12-22-18(21-17)20-11-14-10-19-16-9-5-4-8-15(14)16/h1-12,19H/b20-11+
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9.60E+3n/a 8.56E+3n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246443
PNG
(US9447057, 3)
Show SMILES CCOc1cccc(\C=N\c2nc(cs2)-c2ccccc2)c1O
Show InChI InChI=1S/C18H16N2O2S/c1-2-22-16-10-6-9-14(17(16)21)11-19-18-20-15(12-23-18)13-7-4-3-5-8-13/h3-12,21H,2H2,1H3/b19-11+
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9.70E+3n/a 7.90E+3n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246421
PNG
(US9447057, 7)
Show SMILES C(=N/c1nc(cs1)-c1ccccc1)\c1ccc2ccccc2c1
Show InChI InChI=1S/C20H14N2S/c1-2-7-17(8-3-1)19-14-23-20(22-19)21-13-15-10-11-16-6-4-5-9-18(16)12-15/h1-14H/b21-13+
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1.19E+4n/a 9.33E+3n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246423
PNG
(US9447057, 9)
Show SMILES CC(C)c1ccc(\C=N\c2nc(cs2)-c2ccccc2)cc1
Show InChI InChI=1S/C19H18N2S/c1-14(2)16-10-8-15(9-11-16)12-20-19-21-18(13-22-19)17-6-4-3-5-7-17/h3-14H,1-2H3/b20-12+
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1.24E+4n/a 1.45E+4n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246419
PNG
(US9447057, 5)
Show SMILES C(=N/c1nc(cs1)-c1ccccc1)\c1ccncc1
Show InChI InChI=1S/C15H11N3S/c1-2-4-13(5-3-1)14-11-19-15(18-14)17-10-12-6-8-16-9-7-12/h1-11H/b17-10+
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1.36E+4n/a 7.60E+3n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246424
PNG
(US9447057, 10)
Show SMILES Cc1ccc(\C=N\c2nc(cs2)-c2ccccc2)o1
Show InChI InChI=1S/C15H12N2OS/c1-11-7-8-13(18-11)9-16-15-17-14(10-19-15)12-5-3-2-4-6-12/h2-10H,1H3/b16-9+
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1.48E+4n/a 1.78E+4n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM50229993
PNG
(2-thiourea | CHEMBL260876 | Thiocarbamid | Thiohar...)
Show SMILES NC(N)=S
Show InChI InChI=1S/CH4N2S/c2-1(3)4/h(H4,2,3,4)
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2.00E+4n/a 2.10E+4n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM181092
PNG
(2-(4-(benzo[d]thiazol-2-yl)benzoyl)-N-(2-methoxyph...)
Show SMILES COc1ccccc1NC(=S)NNC(=O)c1ccc(cc1)-c1nc2ccccc2s1
Show InChI InChI=1S/C22H18N4O2S2/c1-28-18-8-4-2-6-16(18)24-22(29)26-25-20(27)14-10-12-15(13-11-14)21-23-17-7-3-5-9-19(17)30-21/h2-13H,1H3,(H,25,27)(H2,24,26,29)
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n/an/a 1.76E+4n/an/an/an/a6.830



Universiti Teknologi MARA (UiTM), Puncak Alam Campus



Assay Description
To understand the binding modes of the compounds given in Table 1, all ligands were docked into the binding site of Urease enzyme. The top ranked con...


Bioorg Chem 66: 80-7 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.010
BindingDB Entry DOI: 10.7270/Q20G3HXW
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM60594
PNG
(N-(adamantan-1-yl)-2-(4-(benzo[d]thiazol-2-yl)benz...)
Show SMILES O=C(NNC(=S)NC12CC3CC(CC(C3)C1)C2)c1ccc(cc1)-c1nc2ccccc2s1 |TLB:10:11:15:8.9.14,14:9:16:15.13.12,14:13:16:8.9.10,THB:10:9:15:16.11.12|
Show InChI InChI=1S/C25H26N4OS2/c30-22(18-5-7-19(8-6-18)23-26-20-3-1-2-4-21(20)32-23)28-29-24(31)27-25-12-15-9-16(13-25)11-17(10-15)14-25/h1-8,15-17H,9-14H2,(H,28,30)(H2,27,29,31)
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n/an/a 3.44E+4n/an/an/an/a6.830



Universiti Teknologi MARA (UiTM), Puncak Alam Campus



Assay Description
To understand the binding modes of the compounds given in Table 1, all ligands were docked into the binding site of Urease enzyme. The top ranked con...


Bioorg Chem 66: 80-7 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.010
BindingDB Entry DOI: 10.7270/Q20G3HXW
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM181094
PNG
(2-(4-(benzo[d]thiazol-2-yl)benzoyl)-N-phenylhydraz...)
Show SMILES O=C(NNC(=S)Nc1ccccc1)c1ccc(cc1)-c1nc2ccccc2s1
Show InChI InChI=1S/C21H16N4OS2/c26-19(24-25-21(27)22-16-6-2-1-3-7-16)14-10-12-15(13-11-14)20-23-17-8-4-5-9-18(17)28-20/h1-13H,(H,24,26)(H2,22,25,27)
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n/an/a 1.91E+4n/an/an/an/a6.830



Universiti Teknologi MARA (UiTM), Puncak Alam Campus



Assay Description
To understand the binding modes of the compounds given in Table 1, all ligands were docked into the binding site of Urease enzyme. The top ranked con...


Bioorg Chem 66: 80-7 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.010
BindingDB Entry DOI: 10.7270/Q20G3HXW
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM50229993
PNG
(2-thiourea | CHEMBL260876 | Thiocarbamid | Thiohar...)
Show SMILES NC(N)=S
Show InChI InChI=1S/CH4N2S/c2-1(3)4/h(H4,2,3,4)
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n/an/a 1.95E+4n/an/an/an/a6.830



Universiti Teknologi MARA (UiTM), Puncak Alam Campus



Assay Description
To understand the binding modes of the compounds given in Table 1, all ligands were docked into the binding site of Urease enzyme. The top ranked con...


Bioorg Chem 66: 80-7 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.010
BindingDB Entry DOI: 10.7270/Q20G3HXW
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM174833
PNG
(3,4,5-Trihydroxy xanthone (1) | US9114126, MB5)
Show SMILES Oc1ccc2c(oc3c(O)cccc3c2=O)c1O
Show InChI InChI=1S/C13H8O5/c14-8-5-4-7-10(16)6-2-1-3-9(15)12(6)18-13(7)11(8)17/h1-5,14-15,17H
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n/an/a 3.80E+4n/an/an/an/a6.830



University of Peshawar



Assay Description
Reaction mixtures comprising 25 μL of enzyme (jack bean urease) solution and 55 μL of buffer containing 100 mM urea were incubated with 5 &...


J Enzyme Inhib Med Chem 25: 296-9 (2010)


Article DOI: 10.3109/14756360903179385
BindingDB Entry DOI: 10.7270/Q2TB15TQ
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM233115
PNG
(Tetracosyl 3-(3,4-dihydroxyphenyl) acrylate (2))
Show SMILES CCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C=Cc1ccc(O)c(O)c1 |w:27.26|
Show InChI InChI=1S/C33H56O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28-37-33(36)27-25-30-24-26-31(34)32(35)29-30/h24-27,29,34-35H,2-23,28H2,1H3/b27-25+
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n/an/a 2.10E+4n/an/an/an/a6.830



University of Peshawar



Assay Description
Reaction mixtures comprising 25 μL of enzyme (jack bean urease) solution and 55 μL of buffer containing 100 mM urea were incubated with 5 &...


J Enzyme Inhib Med Chem 25: 296-9 (2010)


Article DOI: 10.3109/14756360903179385
BindingDB Entry DOI: 10.7270/Q2TB15TQ
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM50155446
PNG
(1,3,7-Trihydroxy xanthone (3) | 1,3,7-Trihydroxy-x...)
Show SMILES Oc1ccc2oc3cc(O)cc(O)c3c(=O)c2c1
Show InChI InChI=1S/C13H8O5/c14-6-1-2-10-8(3-6)13(17)12-9(16)4-7(15)5-11(12)18-10/h1-5,14-16H
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n/an/a 1.38E+5n/an/an/an/a6.830



University of Peshawar



Assay Description
Reaction mixtures comprising 25 μL of enzyme (jack bean urease) solution and 55 μL of buffer containing 100 mM urea were incubated with 5 &...


J Enzyme Inhib Med Chem 25: 296-9 (2010)


Article DOI: 10.3109/14756360903179385
BindingDB Entry DOI: 10.7270/Q2TB15TQ
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM50229993
PNG
(2-thiourea | CHEMBL260876 | Thiocarbamid | Thiohar...)
Show SMILES NC(N)=S
Show InChI InChI=1S/CH4N2S/c2-1(3)4/h(H4,2,3,4)
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n/an/a 2.10E+4n/an/an/an/a6.830



University of Peshawar



Assay Description
Reaction mixtures comprising 25 μL of enzyme (jack bean urease) solution and 55 μL of buffer containing 100 mM urea were incubated with 5 &...


J Enzyme Inhib Med Chem 25: 296-9 (2010)


Article DOI: 10.3109/14756360903179385
BindingDB Entry DOI: 10.7270/Q2TB15TQ
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246425
PNG
(US9447057, 11)
Show SMILES [O-][N+](=O)c1ccc(\C=N\c2nc(cs2)-c2ccccc2)cc1
Show InChI InChI=1S/C16H11N3O2S/c20-19(21)14-8-6-12(7-9-14)10-17-16-18-15(11-22-16)13-4-2-1-3-5-13/h1-11H/b17-10+
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n/an/a 3.25E+4n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246426
PNG
(US9447057, 12)
Show SMILES Oc1ccc(\C=N\c2nc(cs2)-c2ccccc2)cc1
Show InChI InChI=1S/C16H12N2OS/c19-14-8-6-12(7-9-14)10-17-16-18-15(11-20-16)13-4-2-1-3-5-13/h1-11,19H/b17-10+
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n/an/a 2.02E+4n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246427
PNG
(US9447057, 13)
Show SMILES COc1ccc(\C=N\c2nc(cs2)-c2ccccc2)cc1
Show InChI InChI=1S/C17H14N2OS/c1-20-15-9-7-13(8-10-15)11-18-17-19-16(12-21-17)14-5-3-2-4-6-14/h2-12H,1H3/b18-11+
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n/an/a 2.23E+4n/an/an/an/a6.8n/a



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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246428
PNG
(US9447057, 14)
Show SMILES CN(C)c1ccc(\C=N\c2nc(cs2)-c2ccccc2)cc1
Show InChI InChI=1S/C18H17N3S/c1-21(2)16-10-8-14(9-11-16)12-19-18-20-17(13-22-18)15-6-4-3-5-7-15/h3-13H,1-2H3/b19-12+
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246444
PNG
(US9447057, 15)
Show SMILES CCC=Nc1nc(cs1)-c1ccccc1 |w:3.3|
Show InChI InChI=1S/C12H12N2S/c1-2-8-13-12-14-11(9-15-12)10-6-4-3-5-7-10/h3-9H,2H2,1H3/b13-8+
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246429
PNG
(US9447057, 16)
Show SMILES Oc1ccccc1\C=N\c1nc(cs1)-c1ccccc1
Show InChI InChI=1S/C16H12N2OS/c19-15-9-5-4-8-13(15)10-17-16-18-14(11-20-16)12-6-2-1-3-7-12/h1-11,19H/b17-10+
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246430
PNG
(US9447057, 17)
Show SMILES COc1ccc(\C=C\C=N\c2nc(cs2)-c2ccccc2)cc1
Show InChI InChI=1S/C19H16N2OS/c1-22-17-11-9-15(10-12-17)6-5-13-20-19-21-18(14-23-19)16-7-3-2-4-8-16/h2-14H,1H3/b6-5+,20-13+
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US Patent
n/an/a 3.67E+4n/an/an/an/a6.8n/a



TBA

US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246431
PNG
(US9447057, 18)
Show SMILES CSc1ccc(\C=N\c2nc(cs2)-c2ccccc2)cc1
Show InChI InChI=1S/C17H14N2S2/c1-20-15-9-7-13(8-10-15)11-18-17-19-16(12-21-17)14-5-3-2-4-6-14/h2-12H,1H3/b18-11+
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246432
PNG
(US9447057, 19)
Show SMILES C(=N/c1nc(cs1)-c1ccccc1)\c1ccccc1
Show InChI InChI=1S/C16H12N2S/c1-3-7-13(8-4-1)11-17-16-18-15(12-19-16)14-9-5-2-6-10-14/h1-12H/b17-11+
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246433
PNG
(US9447057, 20)
Show SMILES Clc1ccccc1\C=N\c1nc(cs1)-c1ccccc1
Show InChI InChI=1S/C16H11ClN2S/c17-14-9-5-4-8-13(14)10-18-16-19-15(11-20-16)12-6-2-1-3-7-12/h1-11H/b18-10+
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246434
PNG
(US9447057, 21)
Show SMILES C(=N/c1nc(cs1)-c1ccccc1)\c1cccc2ccccc12
Show InChI InChI=1S/C20H14N2S/c1-2-8-16(9-3-1)19-14-23-20(22-19)21-13-17-11-6-10-15-7-4-5-12-18(15)17/h1-14H/b21-13+
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246435
PNG
(US9447057, 22)
Show SMILES Fc1ccccc1\C=N\c1nc(cs1)-c1ccccc1
Show InChI InChI=1S/C16H11FN2S/c17-14-9-5-4-8-13(14)10-18-16-19-15(11-20-16)12-6-2-1-3-7-12/h1-11H/b18-10+
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246436
PNG
(US9447057, 23)
Show SMILES Oc1cccc(\C=N\c2nc(cs2)-c2ccccc2)c1O
Show InChI InChI=1S/C16H12N2O2S/c19-14-8-4-7-12(15(14)20)9-17-16-18-13(10-21-16)11-5-2-1-3-6-11/h1-10,19-20H/b17-9+
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246437
PNG
(US9447057, 24)
Show SMILES COc1ccc(\C=N\c2nc(cs2)-c2ccccc2)cc1OC
Show InChI InChI=1S/C18H16N2O2S/c1-21-16-9-8-13(10-17(16)22-2)11-19-18-20-15(12-23-18)14-6-4-3-5-7-14/h3-12H,1-2H3/b19-11+
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US Patent
n/an/a 1.13E+4n/an/an/an/a6.8n/a



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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246438
PNG
(US9447057, 25)
Show SMILES Clc1cccc(Cl)c1\C=N\c1nc(cs1)-c1ccccc1
Show InChI InChI=1S/C16H10Cl2N2S/c17-13-7-4-8-14(18)12(13)9-19-16-20-15(10-21-16)11-5-2-1-3-6-11/h1-10H/b19-9+
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US Patent
n/an/a 2.23E+4n/an/an/an/a6.8n/a



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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246439
PNG
(US9447057, 26)
Show SMILES Clc1ccc(\C=N\c2nc(cs2)-c2ccccc2)cc1
Show InChI InChI=1S/C16H11ClN2S/c17-14-8-6-12(7-9-14)10-18-16-19-15(11-20-16)13-4-2-1-3-5-13/h1-11H/b18-10+
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246440
PNG
(US9447057, 27)
Show SMILES COCc1c(\C=N\c2nc(cs2)-c2ccccc2)ccc(OC)c1OC
Show InChI InChI=1S/C20H20N2O3S/c1-23-12-16-15(9-10-18(24-2)19(16)25-3)11-21-20-22-17(13-26-20)14-7-5-4-6-8-14/h4-11,13H,12H2,1-3H3/b21-11+
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n/an/a 2.46E+4n/an/an/an/a6.8n/a



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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246441
PNG
(US9447057, 28)
Show SMILES [O-][N+](=O)c1cccc(\C=N\c2nc(cs2)-c2ccccc2)c1
Show InChI InChI=1S/C16H11N3O2S/c20-19(21)14-8-4-5-12(9-14)10-17-16-18-15(11-22-16)13-6-2-1-3-7-13/h1-11H/b17-10+
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US Patent
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US Patent


Assay Description
Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...


US Patent US9447057 (2016)


BindingDB Entry DOI: 10.7270/Q2XG9Q2T
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246469
PNG
(4-(9-Methyl-9H-carbazol-3-yl)-6-phenylpyrimidin-2-...)
Show SMILES Cn1c2ccccc2c2cc(ccc12)-c1cc(nc(N)n1)-c1ccccc1
Show InChI InChI=1S/C23H18N4/c1-27-21-10-6-5-9-17(21)18-13-16(11-12-22(18)27)20-14-19(25-23(24)26-20)15-7-3-2-4-8-15/h2-14H,1H3,(H2,24,25,26)
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n/an/a>1.00E+5n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246470
PNG
(4-(4-Methoxyphenyl)-6-(9-methyl-9H-carbazol-3-yl)-...)
Show SMILES COc1ccc(cc1)-c1cc(nc(N)n1)-c1ccc2n(C)c3ccccc3c2c1
Show InChI InChI=1S/C24H20N4O/c1-28-22-6-4-3-5-18(22)19-13-16(9-12-23(19)28)21-14-20(26-24(25)27-21)15-7-10-17(29-2)11-8-15/h3-14H,1-2H3,(H2,25,26,27)
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n/an/a 9.54E+4n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246471
PNG
(4-(3,4-Dimethoxyphenyl)-6-(9-methyl-9H-carbazol-3-...)
Show SMILES COc1ccc(cc1OC)-c1cc(nc(N)n1)-c1ccc2n(C)c3ccccc3c2c1
Show InChI InChI=1S/C25H22N4O2/c1-29-21-7-5-4-6-17(21)18-12-15(8-10-22(18)29)19-14-20(28-25(26)27-19)16-9-11-23(30-2)24(13-16)31-3/h4-14H,1-3H3,(H2,26,27,28)
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n/an/a 3.07E+4n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246472
PNG
(4-(9-Methyl-9H-carbazol-3-yl)-6-(2,4,6-trimethoxyp...)
Show SMILES COc1cc(OC)c(c(OC)c1)-c1cc(nc(N)n1)-c1ccc2n(C)c3ccccc3c2c1
Show InChI InChI=1S/C26H24N4O3/c1-30-21-8-6-5-7-17(21)18-11-15(9-10-22(18)30)19-14-20(29-26(27)28-19)25-23(32-3)12-16(31-2)13-24(25)33-4/h5-14H,1-4H3,(H2,27,28,29)
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n/an/a 7.37E+4n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246473
PNG
(4-(4-Fluorophenyl)-6-(9-methyl-9H-carbazol-3-yl)-p...)
Show SMILES Cn1c2ccccc2c2cc(ccc12)-c1cc(nc(N)n1)-c1ccc(F)cc1
Show InChI InChI=1S/C23H17FN4/c1-28-21-5-3-2-4-17(21)18-12-15(8-11-22(18)28)20-13-19(26-23(25)27-20)14-6-9-16(24)10-7-14/h2-13H,1H3,(H2,25,26,27)
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Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246474
PNG
(4-(2,4-Difluorophenyl)-6-(9-methyl-9H-carbazol-3-y...)
Show SMILES Cn1c2ccccc2c2cc(ccc12)-c1cc(nc(N)n1)-c1ccc(F)cc1F
Show InChI InChI=1S/C23H16F2N4/c1-29-21-5-3-2-4-15(21)17-10-13(6-9-22(17)29)19-12-20(28-23(26)27-19)16-8-7-14(24)11-18(16)25/h2-12H,1H3,(H2,26,27,28)
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n/an/a 4.02E+4n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246475
PNG
(4-(3,4-Difluorophenyl)-6-(9-methyl-9H-carbazol-3-y...)
Show SMILES Cn1c2ccccc2c2cc(ccc12)-c1cc(nc(N)n1)-c1ccc(F)c(F)c1
Show InChI InChI=1S/C23H16F2N4/c1-29-21-5-3-2-4-15(21)16-10-13(7-9-22(16)29)19-12-20(28-23(26)27-19)14-6-8-17(24)18(25)11-14/h2-12H,1H3,(H2,26,27,28)
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n/an/a 4.52E+4n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246476
PNG
(4-(4-Chlorophenyl)-6-(9-methyl-9H-carbazol-3-yl)-p...)
Show SMILES Cn1c2ccccc2c2cc(ccc12)-c1cc(nc(N)n1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H17ClN4/c1-28-21-5-3-2-4-17(21)18-12-15(8-11-22(18)28)20-13-19(26-23(25)27-20)14-6-9-16(24)10-7-14/h2-13H,1H3,(H2,25,26,27)
PDB
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UniProtKB/SwissProt

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UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246477
PNG
(4-(2,4-Dichlorophenyl)-6-(9-methyl-9H-carbazol-3-y...)
Show SMILES Cn1c2ccccc2c2cc(ccc12)-c1cc(nc(N)n1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C23H16Cl2N4/c1-29-21-5-3-2-4-15(21)17-10-13(6-9-22(17)29)19-12-20(28-23(26)27-19)16-8-7-14(24)11-18(16)25/h2-12H,1H3,(H2,26,27,28)
PDB
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UniProtKB/SwissProt

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UniChem
Article
PubMed
n/an/a 1.94E+4n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246478
PNG
(4-(3,4-Dichlorophenyl)-6-(9-methyl-9H-carbazol-3-y...)
Show SMILES Cn1c2ccccc2c2cc(ccc12)-c1cc(nc(N)n1)-c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C23H16Cl2N4/c1-29-21-5-3-2-4-15(21)16-10-13(7-9-22(16)29)19-12-20(28-23(26)27-19)14-6-8-17(24)18(25)11-14/h2-12H,1H3,(H2,26,27,28)
PDB
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UniChem
Article
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n/an/a 2.32E+4n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246479
PNG
(4-(2,5-Dichlorophenyl)-6-(9-methyl-9H-carbazol-3-y...)
Show SMILES Cn1c2ccccc2c2cc(ccc12)-c1cc(nc(N)n1)-c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C23H16Cl2N4/c1-29-21-5-3-2-4-15(21)16-10-13(6-9-22(16)29)19-12-20(28-23(26)27-19)17-11-14(24)7-8-18(17)25/h2-12H,1H3,(H2,26,27,28)
PDB
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UniChem
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n/an/a 2.81E+4n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246480
PNG
(4-(4-Bromophenyl)-6-(9-methyl-9H-carbazol-3-yl)-py...)
Show SMILES Cn1c2ccccc2c2cc(ccc12)-c1cc(nc(N)n1)-c1ccc(Br)cc1
Show InChI InChI=1S/C23H17BrN4/c1-28-21-5-3-2-4-17(21)18-12-15(8-11-22(18)28)20-13-19(26-23(25)27-20)14-6-9-16(24)10-7-14/h2-13H,1H3,(H2,25,26,27)
PDB
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UniProtKB/SwissProt

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UniChem
Article
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n/an/a 9.51E+4n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
Urease


(Canavalia ensiformis (Jack bean) (Horse bean))
BDBM246481
PNG
(4-(9-Methyl-9H-carbazol-3-yl)-6-(4-nitrophenyl)-py...)
Show SMILES Cn1c2ccccc2c2cc(ccc12)-c1cc(nc(N)n1)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C23H17N5O2/c1-27-21-5-3-2-4-17(21)18-12-15(8-11-22(18)27)20-13-19(25-23(24)26-20)14-6-9-16(10-7-14)28(29)30/h2-13H,1H3,(H2,24,25,26)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.72E+4n/an/an/an/a6.830



Solapur University



Assay Description
Mixture of 25 μL of urease enzyme (Jack bean) solution containing 1 unit of enzyme (1 unit = 0.02 mg of enzyme) was dissolved in phosphate buffe...


J Enzyme Inhib Med Chem 28: 1316-23 (2013)


Article DOI: 10.3109/14756366.2012.740477
BindingDB Entry DOI: 10.7270/Q2J965BH
More data for this
Ligand-Target Pair
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