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Patent code US8957075

Compile Data Set for Download or QSAR
Found 28 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
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147116
PNG
(US8957075, Table 1 Compound 11)
Show SMILES CC1CN(CCN1c1ccc(C)cc1)C(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1
Show InChI InChI=1S/C29H32N4O4S/c1-20-8-11-24(12-9-20)33-17-16-32(19-21(33)2)29(35)28(22-6-4-3-5-7-22)31-38(36,37)25-13-14-26-23(18-25)10-15-27(34)30-26/h3-9,11-14,18,21,28,31H,10,15-17,19H2,1-2H3,(H,30,34)
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n/an/an/a 3.20E+3n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147122
PNG
(US8957075, Table 1 Compound 17)
Show SMILES CN(Cc1ccco1)C(=O)C(Cc1ccccc1)NS(=O)(=O)c1ccc2NC(=O)CCc2c1
Show InChI InChI=1S/C24H25N3O5S/c1-27(16-19-8-5-13-32-19)24(29)22(14-17-6-3-2-4-7-17)26-33(30,31)20-10-11-21-18(15-20)9-12-23(28)25-21/h2-8,10-11,13,15,22,26H,9,12,14,16H2,1H3,(H,25,28)
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n/an/an/a 1.30E+4n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147124
PNG
(US8957075, Table 1 Compound 19 | US8957075, Table ...)
Show SMILES CCOc1ccccc1N(C)S(=O)(=O)c1ccc2[nH]c(=O)ccc2c1
Show InChI InChI=1S/C18H18N2O4S/c1-3-24-17-7-5-4-6-16(17)20(2)25(22,23)14-9-10-15-13(12-14)8-11-18(21)19-15/h4-12H,3H2,1-2H3,(H,19,21)
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n/an/an/a 5.00E+4n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147132
PNG
(US8957075, Table 1 Compound 27)
Show SMILES O=C(C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1)N(Cc1ccco1)Cc1cccs1
Show InChI InChI=1S/C27H25N3O5S2/c31-25-13-10-20-16-23(11-12-24(20)28-25)37(33,34)29-26(19-6-2-1-3-7-19)27(32)30(17-21-8-4-14-35-21)18-22-9-5-15-36-22/h1-9,11-12,14-16,26,29H,10,13,17-18H2,(H,28,31)
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n/an/an/a 4.00E+3n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147113
PNG
(US8957075, Table 1 Compound 8)
Show SMILES O=C(C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1)N1CCN(CC1)C1CCCCC1
Show InChI InChI=1S/C27H34N4O4S/c32-25-14-11-21-19-23(12-13-24(21)28-25)36(34,35)29-26(20-7-3-1-4-8-20)27(33)31-17-15-30(16-18-31)22-9-5-2-6-10-22/h1,3-4,7-8,12-13,19,22,26,29H,2,5-6,9-11,14-18H2,(H,28,32)
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n/an/an/a 2.00E+4n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147114
PNG
(US8957075, Table 1 Compound 9)
Show SMILES Cc1ccc(NC(=O)C(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)c2ccccc2)c(Br)c1
Show InChI InChI=1S/C24H22BrN3O4S/c1-15-7-10-21(19(25)13-15)27-24(30)23(16-5-3-2-4-6-16)28-33(31,32)18-9-11-20-17(14-18)8-12-22(29)26-20/h2-7,9-11,13-14,23,28H,8,12H2,1H3,(H,26,29)(H,27,30)
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n/an/an/a 5.20E+4n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147124
PNG
(US8957075, Table 1 Compound 19 | US8957075, Table ...)
Show SMILES CCOc1ccccc1N(C)S(=O)(=O)c1ccc2[nH]c(=O)ccc2c1
Show InChI InChI=1S/C18H18N2O4S/c1-3-24-17-7-5-4-6-16(17)20(2)25(22,23)14-9-10-15-13(12-14)8-11-18(21)19-15/h4-12H,3H2,1-2H3,(H,19,21)
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n/an/an/a 4.10E+3n/an/an/an/an/a



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US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147111
PNG
(US8957075, Table 1 Compound 5)
Show SMILES Cc1cccc(C)c1NC(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1
Show InChI InChI=1S/C25H25N3O4S/c1-16-7-6-8-17(2)23(16)27-25(30)24(18-9-4-3-5-10-18)28-33(31,32)20-12-13-21-19(15-20)11-14-22(29)26-21/h3-10,12-13,15,24,28H,11,14H2,1-2H3,(H,26,29)(H,27,30)
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n/an/an/a 3.70E+4n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147107
PNG
(US8957075, Table 1 Compound 1)
Show SMILES CN(C(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1)c1cccc(C)c1
Show InChI InChI=1S/C25H25N3O4S/c1-17-7-6-10-20(15-17)28(2)25(30)24(18-8-4-3-5-9-18)27-33(31,32)21-12-13-22-19(16-21)11-14-23(29)26-22/h3-10,12-13,15-16,24,27H,11,14H2,1-2H3,(H,26,29)
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n/an/an/a 7.40E+3n/an/an/an/an/a



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US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147108
PNG
(US8957075, Table 1 Compound 2)
Show SMILES COc1cccc(c1)N1CCN(CC1)C(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1
Show InChI InChI=1S/C28H30N4O5S/c1-37-23-9-5-8-22(19-23)31-14-16-32(17-15-31)28(34)27(20-6-3-2-4-7-20)30-38(35,36)24-11-12-25-21(18-24)10-13-26(33)29-25/h2-9,11-12,18-19,27,30H,10,13-17H2,1H3,(H,29,33)
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n/an/an/a 6.30E+3n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147117
PNG
(US8957075, Table 1 Compound 12)
Show SMILES CC(N(Cc1ccco1)C(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1)c1cccs1
Show InChI InChI=1S/C28H27N3O5S2/c1-19(25-10-6-16-37-25)31(18-22-9-5-15-36-22)28(33)27(20-7-3-2-4-8-20)30-38(34,35)23-12-13-24-21(17-23)11-14-26(32)29-24/h2-10,12-13,15-17,19,27,30H,11,14,18H2,1H3,(H,29,32)
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n/an/an/a 1.60E+3n/an/an/an/an/a



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US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147119
PNG
(US8957075, Table 1 Compound 14 | US8957075, Table ...)
Show SMILES CC(C)N(Cc1ccccc1)C(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1
Show InChI InChI=1S/C27H29N3O4S/c1-19(2)30(18-20-9-5-3-6-10-20)27(32)26(21-11-7-4-8-12-21)29-35(33,34)23-14-15-24-22(17-23)13-16-25(31)28-24/h3-12,14-15,17,19,26,29H,13,16,18H2,1-2H3,(H,28,31)
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n/an/an/a 5.70E+3n/an/an/an/an/a



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US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147125
PNG
(US8957075, Table 1 Compound 20)
Show SMILES COc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1OC
Show InChI InChI=1S/C17H16N2O5S/c1-23-15-7-4-12(10-16(15)24-2)19-25(21,22)13-5-6-14-11(9-13)3-8-17(20)18-14/h3-10,19H,1-2H3,(H,18,20)
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n/an/an/a 7.20E+3n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147130
PNG
(US8957075, Table 1 Compound 25)
Show SMILES COc1cc2CCN(C(C)c2cc1OC)S(=O)(=O)c1ccc2[nH]c(=O)ccc2c1
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n/an/an/a 5.00E+4n/an/an/an/an/a



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US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147109
PNG
(US8957075, Table 1 Compound 3)
Show SMILES Clc1ccc(CNC(=O)C(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)c2ccccc2)cc1
Show InChI InChI=1S/C24H22ClN3O4S/c25-19-9-6-16(7-10-19)15-26-24(30)23(17-4-2-1-3-5-17)28-33(31,32)20-11-12-21-18(14-20)8-13-22(29)27-21/h1-7,9-12,14,23,28H,8,13,15H2,(H,26,30)(H,27,29)
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n/an/an/a 6.60E+3n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147110
PNG
(US8957075, Table 1 Compound 4)
Show SMILES O=C(C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1)N1CCC(Cc2ccccc2)CC1
Show InChI InChI=1S/C29H31N3O4S/c33-27-14-11-24-20-25(12-13-26(24)30-27)37(35,36)31-28(23-9-5-2-6-10-23)29(34)32-17-15-22(16-18-32)19-21-7-3-1-4-8-21/h1-10,12-13,20,22,28,31H,11,14-19H2,(H,30,33)
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n/an/an/a 2.00E+3n/an/an/an/an/a



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US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147121
PNG
(US8957075, Table 1 Compound 16)
Show SMILES OC(=O)CC(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1cccc(Cl)c1
Show InChI InChI=1S/C18H17ClN2O5S/c19-13-3-1-2-11(8-13)16(10-18(23)24)21-27(25,26)14-5-6-15-12(9-14)4-7-17(22)20-15/h1-3,5-6,8-9,16,21H,4,7,10H2,(H,20,22)(H,23,24)
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n/an/an/a 1.50E+4n/an/an/an/an/a



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US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147129
PNG
(US8957075, Table 1 Compound 24)
Show SMILES O=C(NCc1ccccc1)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1
Show InChI InChI=1S/C24H23N3O4S/c28-22-14-11-19-15-20(12-13-21(19)26-22)32(30,31)27-23(18-9-5-2-6-10-18)24(29)25-16-17-7-3-1-4-8-17/h1-10,12-13,15,23,27H,11,14,16H2,(H,25,29)(H,26,28)
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n/an/an/a 1.25E+5n/an/an/an/an/a



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US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147128
PNG
(US8957075, Table 1 Compound 23)
Show SMILES CN(CC(=O)Nc1nc2ccc(Cl)cc2s1)S(=O)(=O)c1ccc2[nH]c(=O)ccc2c1
Show InChI InChI=1S/C19H15ClN4O4S2/c1-24(10-18(26)23-19-22-15-5-3-12(20)9-16(15)29-19)30(27,28)13-4-6-14-11(8-13)2-7-17(25)21-14/h2-9H,10H2,1H3,(H,21,25)(H,22,23,26)
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n/an/an/a 6.00E+4n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147119
PNG
(US8957075, Table 1 Compound 14 | US8957075, Table ...)
Show SMILES CC(C)N(Cc1ccccc1)C(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1
Show InChI InChI=1S/C27H29N3O4S/c1-19(2)30(18-20-9-5-3-6-10-20)27(32)26(21-11-7-4-8-12-21)29-35(33,34)23-14-15-24-22(17-23)13-16-25(31)28-24/h3-12,14-15,17,19,26,29H,13,16,18H2,1-2H3,(H,28,31)
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n/an/an/a 7.00E+3n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147133
PNG
(US8957075, Table 1 Compound 28)
Show SMILES O=C(C(NS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)c1ccccc1)N(Cc1ccco1)Cc1cccs1
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n/an/an/a 400n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM51358
PNG
(2-keto-N-[2-keto-1-phenyl-2-[4-(2-pyridyl)piperazi...)
Show SMILES O=C(C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1)N1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C26H27N5O4S/c32-24-12-9-20-18-21(10-11-22(20)28-24)36(34,35)29-25(19-6-2-1-3-7-19)26(33)31-16-14-30(15-17-31)23-8-4-5-13-27-23/h1-8,10-11,13,18,25,29H,9,12,14-17H2,(H,28,32)
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n/an/an/a 4.20E+3n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147112
PNG
(US8957075, Table 1 Compound 7)
Show SMILES CCc1cccc(C)c1NC(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1
Show InChI InChI=1S/C26H27N3O4S/c1-3-18-11-7-8-17(2)24(18)28-26(31)25(19-9-5-4-6-10-19)29-34(32,33)21-13-14-22-20(16-21)12-15-23(30)27-22/h4-11,13-14,16,25,29H,3,12,15H2,1-2H3,(H,27,30)(H,28,31)
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n/an/an/a 9.70E+4n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147118
PNG
(US8957075, Table 1 Compound 13)
Show SMILES Cc1cc(C)c(NC(=O)C(NS(=O)(=O)c2ccc3NC(=O)CCc3c2)c2ccccc2)c(C)c1
Show InChI InChI=1S/C26H27N3O4S/c1-16-13-17(2)24(18(3)14-16)28-26(31)25(19-7-5-4-6-8-19)29-34(32,33)21-10-11-22-20(15-21)9-12-23(30)27-22/h4-8,10-11,13-15,25,29H,9,12H2,1-3H3,(H,27,30)(H,28,31)
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n/an/an/a 5.60E+3n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147120
PNG
(US8957075, Table 1 Compound 15)
Show SMILES CCN(CC)C(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1
Show InChI InChI=1S/C21H25N3O4S/c1-3-24(4-2)21(26)20(15-8-6-5-7-9-15)23-29(27,28)17-11-12-18-16(14-17)10-13-19(25)22-18/h5-9,11-12,14,20,23H,3-4,10,13H2,1-2H3,(H,22,25)
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n/an/an/a 2.10E+4n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147127
PNG
(US8957075, Table 1 Compound 22)
Show SMILES Cc1ccc(cc1)N1CCN(CC1)C(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1
Show InChI InChI=1S/C28H30N4O4S/c1-20-7-10-23(11-8-20)31-15-17-32(18-16-31)28(34)27(21-5-3-2-4-6-21)30-37(35,36)24-12-13-25-22(19-24)9-14-26(33)29-25/h2-8,10-13,19,27,30H,9,14-18H2,1H3,(H,29,33)
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n/an/an/a 9.00E+3n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147115
PNG
(US8957075, Table 1 Compound 10)
Show SMILES O=C(C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1)N1CCN(CC1)C(=O)c1ccco1
Show InChI InChI=1S/C26H26N4O6S/c31-23-11-8-19-17-20(9-10-21(19)27-23)37(34,35)28-24(18-5-2-1-3-6-18)26(33)30-14-12-29(13-15-30)25(32)22-7-4-16-36-22/h1-7,9-10,16-17,24,28H,8,11-15H2,(H,27,31)
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n/an/an/a 1.10E+4n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit


(Homo sapiens (Human))		BDBM147123
PNG
(US8957075, Table 1 Compound 18)
Show SMILES CCOc1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1
Show InChI InChI=1S/C17H16N2O4S/c1-2-23-16-6-4-3-5-15(16)19-24(21,22)13-8-9-14-12(11-13)7-10-17(20)18-14/h3-11,19H,2H2,1H3,(H,18,20)
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n/an/an/a 4.70E+3n/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
384-well plates (Costar #3654) were filled using a liquid handling robot with 20 uL of a mixture of 50 nM of a fluorescein-linked UDP-GlcNAc analog (...

US Patent US8957075 (2015)


BindingDB Entry DOI: 10.7270/Q2F76B82
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%