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Compile Data Set for Download or QSAR

Found 808 hits Enz. Inhib. hit(s) with all data for entry = 1093   
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
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308636
PNG
(BDBM308807 | US9656955, Example 150 | trans-N-[2-c...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](NCc2ccc(cc2Cl)C(F)(F)F)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C22H21ClF4N4O2S/c1-30-12-21(29-13-30)34(32,33)31-10-18(14-3-6-17(24)7-4-14)20(11-31)28-9-15-2-5-16(8-19(15)23)22(25,26)27/h2-8,12-13,18,20,28H,9-11H2,1H3/t18-,20+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309284
PNG
(5-chloro-N-{(3R,4S)-1-[(1-methyl-1H-imidazol-4-yl)...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cc(OCC(F)(F)F)c(Cl)cn2)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C21H21ClF3N5O3S/c1-29-11-20(27-13-29)34(31,32)30-9-15(14-5-3-2-4-6-14)17(10-30)28-19-7-18(16(22)8-26-19)33-12-21(23,24)25/h2-8,11,13,15,17H,9-10,12H2,1H3,(H,26,28)/t15-,17+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309285
PNG
(N-{((3R,4S)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](C(ONc2ccccn2)C(F)(F)F)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C21H22F3N5O3S/c1-28-13-19(26-14-28)33(30,31)29-11-16(15-7-3-2-4-8-15)17(12-29)20(21(22,23)24)32-27-18-9-5-6-10-25-18/h2-10,13-14,16-17,20H,11-12H2,1H3,(H,25,27)/t16-,17+,20?/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309286
PNG
(5-fluoro-N-{(3R,4S)-4-(4-fluorophenyl)-1-[(1-methy...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cc(OCC(F)(F)F)c(F)cn2)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C21H20F5N5O3S/c1-30-10-20(28-12-30)35(32,33)31-8-15(13-2-4-14(22)5-3-13)17(9-31)29-19-6-18(16(23)7-27-19)34-11-21(24,25)26/h2-7,10,12,15,17H,8-9,11H2,1H3,(H,27,29)/t15-,17+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309291
PNG
(Trans-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]-4-(t...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2cccc(OCC(F)(F)F)c2)[C@@H](C1)C1CCCCO1
Show InChI InChI=1S/C21H27F3N4O4S/c1-27-12-20(25-14-27)33(29,30)28-10-17(19-7-2-3-8-31-19)18(11-28)26-15-5-4-6-16(9-15)32-13-21(22,23)24/h4-6,9,12,14,17-19,26H,2-3,7-8,10-11,13H2,1H3/t17-,18-,19?/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309293
PNG
(Trans-N-[2-chloro-4-(trifluoromethyl)benzyl]-4-(3-...)
Show SMILES Cn1cc(nn1)S(=O)(=O)N1C[C@@H](NCc2ccc(cc2Cl)C(F)(F)F)[C@@H](C1)c1ncccc1F
Show InChI InChI=1S/C20H19ClF4N6O2S/c1-30-11-18(28-29-30)34(32,33)31-9-14(19-16(22)3-2-6-26-19)17(10-31)27-8-12-4-5-13(7-15(12)21)20(23,24)25/h2-7,11,14,17,27H,8-10H2,1H3/t14-,17-/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308599
PNG
(US9656955, Example 85 | trans-4-(4-fluorophenyl)-1...)
Show SMILES Cc1cccc(N[C@@H]2CN(C[C@H]2c2ccc(F)cc2)S(=O)(=O)c2cn(C)cn2)c1
Show InChI InChI=1S/C21H23FN4O2S/c1-15-4-3-5-18(10-15)24-20-12-26(29(27,28)21-13-25(2)14-23-21)11-19(20)16-6-8-17(22)9-7-16/h3-10,13-14,19-20,24H,11-12H2,1-2H3/t19-,20+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308602
PNG
(BDBM308812 | US9656955, Example 88 | trans-4-(4-fl...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2cccc(c2)C(F)(F)F)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C21H20F4N4O2S/c1-28-12-20(26-13-28)32(30,31)29-10-18(14-5-7-16(22)8-6-14)19(11-29)27-17-4-2-3-15(9-17)21(23,24)25/h2-9,12-13,18-19,27H,10-11H2,1H3/t18-,19+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308608
PNG
(BDBM308811 | US9656955, Example 94 | trans-N-(3-ch...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2cccc(Cl)c2)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C20H20ClFN4O2S/c1-25-12-20(23-13-25)29(27,28)26-10-18(14-5-7-16(22)8-6-14)19(11-26)24-17-4-2-3-15(21)9-17/h2-9,12-13,18-19,24H,10-11H2,1H3/t18-,19+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309311
PNG
(US9656955, Example 836 | trans-4-(4-fluorophenyl)-...)
Show SMILES Cn1cc(nn1)S(=O)(=O)N1C[C@@H](Nc2cccc(OCC(F)(F)F)c2)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C21H21F4N5O3S/c1-29-12-20(27-28-29)34(31,32)30-10-18(14-5-7-15(22)8-6-14)19(11-30)26-16-3-2-4-17(9-16)33-13-21(23,24)25/h2-9,12,18-19,26H,10-11,13H2,1H3/t18-,19+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309312
PNG
((3R,4S)-4-(4-fluorophenyl)-1-[(1-methyl-1H-1,2,3-t...)
Show SMILES Cn1cc(nn1)S(=O)(=O)N1C[C@H](Nc2cccc(OC(F)(F)F)c2)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C20H19F4N5O3S/c1-28-12-19(26-27-28)33(30,31)29-10-17(13-5-7-14(21)8-6-13)18(11-29)25-15-3-2-4-16(9-15)32-20(22,23)24/h2-9,12,17-18,25H,10-11H2,1H3/t17-,18+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309313
PNG
((3R,4S)-4-(4-fluorophenyl)-N-[4-fluoro-3-(trifluor...)
Show SMILES Cn1cc(nn1)S(=O)(=O)N1C[C@H](Nc2ccc(F)c(OC(F)(F)F)c2)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C20H18F5N5O3S/c1-29-11-19(27-28-29)34(31,32)30-9-15(12-2-4-13(21)5-3-12)17(10-30)26-14-6-7-16(22)18(8-14)33-20(23,24)25/h2-8,11,15,17,26H,9-10H2,1H3/t15-,17+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309314
PNG
((3R,4S)-4-(4-fluorophenyl)-1-[(1-methyl-1H-1,2,3-t...)
Show SMILES Cn1cc(nn1)S(=O)(=O)N1C[C@H](Nc2cccc(c2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C20H19F4N5O2S/c1-28-12-19(26-27-28)32(30,31)29-10-17(13-5-7-15(21)8-6-13)18(11-29)25-16-4-2-3-14(9-16)20(22,23)24/h2-9,12,17-18,25H,10-11H2,1H3/t17-,18+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309315
PNG
((3R,4S)-4-(4-fluorophenyl)-N-[4-fluoro-3-(trifluor...)
Show SMILES Cn1cc(nn1)S(=O)(=O)N1C[C@H](Nc2ccc(F)c(c2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C20H18F5N5O2S/c1-29-11-19(27-28-29)33(31,32)30-9-15(12-2-4-13(21)5-3-12)18(10-30)26-14-6-7-17(22)16(8-14)20(23,24)25/h2-8,11,15,18,26H,9-10H2,1H3/t15-,18+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309316
PNG
((3R,4S)-N-(3-chlorophenyl)-4-(4-fluorophenyl)-1-[(...)
Show SMILES Cn1cc(nn1)S(=O)(=O)N1C[C@H](Nc2cccc(Cl)c2)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C19H19ClFN5O2S/c1-25-12-19(23-24-25)29(27,28)26-10-17(13-5-7-15(21)8-6-13)18(11-26)22-16-4-2-3-14(20)9-16/h2-9,12,17-18,22H,10-11H2,1H3/t17-,18+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309317
PNG
((3R,4S)-N-(3-chloro-4-fluorophenyl)-4-(4-fluorophe...)
Show SMILES Cn1cc(nn1)S(=O)(=O)N1C[C@H](Nc2ccc(F)c(Cl)c2)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C19H18ClF2N5O2S/c1-26-11-19(24-25-26)30(28,29)27-9-15(12-2-4-13(21)5-3-12)18(10-27)23-14-6-7-17(22)16(20)8-14/h2-8,11,15,18,23H,9-10H2,1H3/t15-,18+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308645
PNG
(US9656955, Example 159 | trans-4-(4-fluorophenyl)-...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2ccc(F)c(c2)C(F)(F)F)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C21H19F5N4O2S/c1-29-11-20(27-12-29)33(31,32)30-9-16(13-2-4-14(22)5-3-13)19(10-30)28-15-6-7-18(23)17(8-15)21(24,25)26/h2-8,11-12,16,19,28H,9-10H2,1H3/t16-,19+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308646
PNG
(BDBM308873 | US9656955, Example 160 | trans-N-(3-c...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2ccc(F)c(Cl)c2)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C20H19ClF2N4O2S/c1-26-11-20(24-12-26)30(28,29)27-9-16(13-2-4-14(22)5-3-13)19(10-27)25-15-6-7-18(23)17(21)8-15/h2-8,11-12,16,19,25H,9-10H2,1H3/t16-,19+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308662
PNG
(BDBM308809 | US9656955, Example 176 | trans-4-(4-f...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2cccc(OC(F)(F)F)c2)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C21H20F4N4O3S/c1-28-12-20(26-13-28)33(30,31)29-10-18(14-5-7-15(22)8-6-14)19(11-29)27-16-3-2-4-17(9-16)32-21(23,24)25/h2-9,12-13,18-19,27H,10-11H2,1H3/t18-,19+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308706
PNG
(US9656955, Example 220 | trans-1-[(1-methyl-1H-imi...)
Show SMILES CC(C)c1cccc(N[C@@H]2CN(C[C@H]2c2ccccc2)S(=O)(=O)c2cn(C)cn2)c1
Show InChI InChI=1S/C23H28N4O2S/c1-17(2)19-10-7-11-20(12-19)25-22-14-27(13-21(22)18-8-5-4-6-9-18)30(28,29)23-15-26(3)16-24-23/h4-12,15-17,21-22,25H,13-14H2,1-3H3/t21-,22+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308712
PNG
(US9656955, Example 226 | trans-1-[(1-methyl-1H-imi...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2cccc(OC(F)(F)F)c2)[C@@H](C1)c1ccccc1
Show InChI InChI=1S/C21H21F3N4O3S/c1-27-13-20(25-14-27)32(29,30)28-11-18(15-6-3-2-4-7-15)19(12-28)26-16-8-5-9-17(10-16)31-21(22,23)24/h2-10,13-14,18-19,26H,11-12H2,1H3/t18-,19+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308815
PNG
((3R,4S)-4-(4-fluorophenyl)-1-[(1-methyl-1H-imidazo...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cccc(OC(F)(F)F)c2)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C21H20F4N4O3S/c1-28-12-20(26-13-28)33(30,31)29-10-18(14-5-7-15(22)8-6-14)19(11-29)27-16-3-2-4-17(9-16)32-21(23,24)25/h2-9,12-13,18-19,27H,10-11H2,1H3/t18-,19+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308733
PNG
(4-{[trans-3-(4-fluorophenyl)-4-{[3-(trifluorometho...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](COc2cccc(OC(F)(F)F)c2)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C22H21F4N3O4S/c1-28-12-21(27-14-28)34(30,31)29-10-16(20(11-29)15-5-7-17(23)8-6-15)13-32-18-3-2-4-19(9-18)33-22(24,25)26/h2-9,12,14,16,20H,10-11,13H2,1H3/t16-,20-/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308748
PNG
(US9656955, Example 262 | trans-N-(4-chlorobenzyl)-...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](NCc2ccc(Cl)cc2)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C21H22ClFN4O2S/c1-26-13-21(25-14-26)30(28,29)27-11-19(16-4-8-18(23)9-5-16)20(12-27)24-10-15-2-6-17(22)7-3-15/h2-9,13-14,19-20,24H,10-12H2,1H3/t19-,20+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308753
PNG
(US9656955, Example 267 | trans-4-(4-fluorophenyl)-...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](NCc2ccc(cc2)C(F)(F)F)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C22H22F4N4O2S/c1-29-13-21(28-14-29)33(31,32)30-11-19(16-4-8-18(23)9-5-16)20(12-30)27-10-15-2-6-17(7-3-15)22(24,25)26/h2-9,13-14,19-20,27H,10-12H2,1H3/t19-,20+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308766
PNG
(US9656955, Example 280 | trans-N-(2,4-dichlorobenz...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](NCc2ccc(Cl)cc2Cl)[C@@H](C1)c1ccccc1
Show InChI InChI=1S/C21H22Cl2N4O2S/c1-26-13-21(25-14-26)30(28,29)27-11-18(15-5-3-2-4-6-15)20(12-27)24-10-16-7-8-17(22)9-19(16)23/h2-9,13-14,18,20,24H,10-12H2,1H3/t18-,20+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308767
PNG
(BDBM308881 | US9656955, Example 281 | trans-N-[2-c...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](NCc2ccc(cc2Cl)C(F)(F)F)[C@@H](C1)c1ccccc1
Show InChI InChI=1S/C22H22ClF3N4O2S/c1-29-13-21(28-14-29)33(31,32)30-11-18(15-5-3-2-4-6-15)20(12-30)27-10-16-7-8-17(9-19(16)23)22(24,25)26/h2-9,13-14,18,20,27H,10-12H2,1H3/t18-,20+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308773
PNG
(N-{trans-4-(4-fluorophenyl)-1-[(1-methyl-1H-imidaz...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2cc(ccn2)C(F)(F)F)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C20H19F4N5O2S/c1-28-11-19(26-12-28)32(30,31)29-9-16(13-2-4-15(21)5-3-13)17(10-29)27-18-8-14(6-7-25-18)20(22,23)24/h2-8,11-12,16-17H,9-10H2,1H3,(H,25,27)/t16-,17+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308780
PNG
(4-{[trans-3-{[2-chloro-4-(trifluoromethyl)phenoxy]...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](COc2ccc(cc2Cl)C(F)(F)F)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C22H20ClF4N3O3S/c1-29-11-21(28-13-29)34(31,32)30-9-15(18(10-30)14-2-5-17(24)6-3-14)12-33-20-7-4-16(8-19(20)23)22(25,26)27/h2-8,11,13,15,18H,9-10,12H2,1H3/t15-,18-/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308783
PNG
((3-chlorophenyl){trans-4-(4-fluorophenyl)-1-[(1-me...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H]([C@@H](C1)c1ccc(F)cc1)C(=O)c1cccc(Cl)c1
Show InChI InChI=1S/C21H19ClFN3O3S/c1-25-12-20(24-13-25)30(28,29)26-10-18(14-5-7-17(23)8-6-14)19(11-26)21(27)15-3-2-4-16(22)9-15/h2-9,12-13,18-19H,10-11H2,1H3/t18-,19+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308784
PNG
(US9656955, Example 298 | trans-N-[4-fluoro-3-(trif...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2ccc(F)c(OC(F)(F)F)c2)[C@@H](C1)c1ccccc1
Show InChI InChI=1S/C21H20F4N4O3S/c1-28-12-20(26-13-28)33(30,31)29-10-16(14-5-3-2-4-6-14)18(11-29)27-15-7-8-17(22)19(9-15)32-21(23,24)25/h2-9,12-13,16,18,27H,10-11H2,1H3/t16-,18+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308791
PNG
(US9656955, Example 305 | trans-4-(4-fluorophenyl)-...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2ccc(F)c(OC(F)(F)F)c2)[C@@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C21H19F5N4O3S/c1-29-11-20(27-12-29)34(31,32)30-9-16(13-2-4-14(22)5-3-13)18(10-30)28-15-6-7-17(23)19(8-15)33-21(24,25)26/h2-8,11-12,16,18,28H,9-10H2,1H3/t16-,18+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308806
PNG
(US9656955, Example 320 | trans-N-[2-chloro-4-(trif...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](NCc2ccc(cc2Cl)C(F)(F)F)[C@@H](C1)c1ccccn1
Show InChI InChI=1S/C21H21ClF3N5O2S/c1-29-12-20(28-13-29)33(31,32)30-10-16(18-4-2-3-7-26-18)19(11-30)27-9-14-5-6-15(8-17(14)22)21(23,24)25/h2-8,12-13,16,19,27H,9-11H2,1H3/t16-,19+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308808
PNG
((3R,4S)?N-[2-chloro-4-(trifluoromethyl)benzyl]-4-(...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](NCc2ccc(cc2Cl)C(F)(F)F)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C22H21ClF4N4O2S/c1-30-12-21(29-13-30)34(32,33)31-10-18(14-3-6-17(24)7-4-14)20(11-31)28-9-15-2-5-16(8-19(15)23)22(25,26)27/h2-8,12-13,18,20,28H,9-11H2,1H3/t18-,20+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308813
PNG
((3R,4S)-4-(4-fluorophenyl)-1-[(1-methyl-1H-imidazo...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cccc(c2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C21H20F4N4O2S/c1-28-12-20(26-13-28)32(30,31)29-10-18(14-5-7-16(22)8-6-14)19(11-29)27-17-4-2-3-15(9-17)21(23,24)25/h2-9,12-13,18-19,27H,10-11H2,1H3/t18-,19+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308815
PNG
((3R,4S)-4-(4-fluorophenyl)-1-[(1-methyl-1H-imidazo...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cccc(OC(F)(F)F)c2)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C21H20F4N4O3S/c1-28-12-20(26-13-28)33(30,31)29-10-18(14-5-7-15(22)8-6-14)19(11-29)27-16-3-2-4-17(9-16)32-21(23,24)25/h2-9,12-13,18-19,27H,10-11H2,1H3/t18-,19+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308838
PNG
((3R,4S)-N-(3-chloro-4-fluorophenyl)-4-(4-fluorophe...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2ccc(F)c(Cl)c2)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C20H19ClF2N4O2S/c1-26-11-20(24-12-26)30(28,29)27-9-16(13-2-4-14(22)5-3-13)19(10-27)25-15-6-7-18(23)17(21)8-15/h2-8,11-12,16,19,25H,9-10H2,1H3/t16-,19+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308854
PNG
(N-{(3R,4S)-4-(4-fluorophenyl)-1-[(1-methyl-1H-imid...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cc(ccn2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C20H19F4N5O2S/c1-28-11-19(26-12-28)32(30,31)29-9-16(13-2-4-15(21)5-3-13)17(10-29)27-18-8-14(6-7-25-18)20(22,23)24/h2-8,11-12,16-17H,9-10H2,1H3,(H,25,27)/t16-,17+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308876
PNG
(N-{(3R,4S)-4-(4-fluorophenyl)-1-[(1-methyl-1H-imid...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cc(ncn2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C19H18F4N6O2S/c1-28-9-18(26-11-28)32(30,31)29-7-14(12-2-4-13(20)5-3-12)15(8-29)27-17-6-16(19(21,22)23)24-10-25-17/h2-6,9-11,14-15H,7-8H2,1H3,(H,24,25,27)/t14-,15+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308876
PNG
(N-{(3R,4S)-4-(4-fluorophenyl)-1-[(1-methyl-1H-imid...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cc(ncn2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C19H18F4N6O2S/c1-28-9-18(26-11-28)32(30,31)29-7-14(12-2-4-13(20)5-3-12)15(8-29)27-17-6-16(19(21,22)23)24-10-25-17/h2-6,9-11,14-15H,7-8H2,1H3,(H,24,25,27)/t14-,15+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308879
PNG
((3R,4S)-N-[(5-chlorothiophen-2-yl)methyl]-4-(4-flu...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](NCc2ccc(Cl)s2)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C19H20ClFN4O2S2/c1-24-11-19(23-12-24)29(26,27)25-9-16(13-2-4-14(21)5-3-13)17(10-25)22-8-15-6-7-18(20)28-15/h2-7,11-12,16-17,22H,8-10H2,1H3/t16-,17+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308880
PNG
((3R,4S)-N-[2-chloro-4-(trifluoromethyl)benzyl]-1-[...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](NCc2ccc(cc2Cl)C(F)(F)F)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C22H22ClF3N4O2S/c1-29-13-21(28-14-29)33(31,32)30-11-18(15-5-3-2-4-6-15)20(12-30)27-10-16-7-8-17(9-19(16)23)22(24,25)26/h2-9,13-14,18,20,27H,10-12H2,1H3/t18-,20+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308882
PNG
(N-{(3R,4S)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cc(ccn2)C(F)(F)F)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C20H20F3N5O2S/c1-27-12-19(25-13-27)31(29,30)28-10-16(14-5-3-2-4-6-14)17(11-28)26-18-9-15(7-8-24-18)20(21,22)23/h2-9,12-13,16-17H,10-11H2,1H3,(H,24,26)/t16-,17+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308883
PNG
((3R,4S)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]-4-...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cccc(c2)C(F)(F)F)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C21H21F3N4O2S/c1-27-13-20(25-14-27)31(29,30)28-11-18(15-6-3-2-4-7-15)19(12-28)26-17-9-5-8-16(10-17)21(22,23)24/h2-10,13-14,18-19,26H,11-12H2,1H3/t18-,19+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308884
PNG
((3R,4S)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]-4-...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](NCc2ccc(cc2)C(F)(F)F)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C22H23F3N4O2S/c1-28-14-21(27-15-28)32(30,31)29-12-19(17-5-3-2-4-6-17)20(13-29)26-11-16-7-9-18(10-8-16)22(23,24)25/h2-10,14-15,19-20,26H,11-13H2,1H3/t19-,20+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308902
PNG
((3R,4S)-N-(3-chloro-4-fluorophenyl)-1-[(1-methyl-1...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2ccc(F)c(Cl)c2)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C20H20ClFN4O2S/c1-25-12-20(23-13-25)29(27,28)26-10-16(14-5-3-2-4-6-14)19(11-26)24-15-7-8-18(22)17(21)9-15/h2-9,12-13,16,19,24H,10-11H2,1H3/t16-,19+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM308910
PNG
(Trans-4-cyclohexyl-1-[(1-methyl-1H-imidazol-4-yl)s...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@@H](Nc2cccc(OC(F)(F)F)c2)[C@@H](C1)C1CCCCC1
Show InChI InChI=1S/C21H27F3N4O3S/c1-27-13-20(25-14-27)32(29,30)28-11-18(15-6-3-2-4-7-15)19(12-28)26-16-8-5-9-17(10-16)31-21(22,23)24/h5,8-10,13-15,18-19,26H,2-4,6-7,11-12H2,1H3/t18-,19+/m0/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309027
PNG
((3R,4S)-N-hexyl-1-[(1-methyl-1H-imidazol-4-yl)sulf...)
Show SMILES CCCCCCN[C@H]1CN(C[C@@H]1c1ccccc1)S(=O)(=O)c1cn(C)cn1
Show InChI InChI=1S/C20H30N4O2S/c1-3-4-5-9-12-21-19-14-24(13-18(19)17-10-7-6-8-11-17)27(25,26)20-15-23(2)16-22-20/h6-8,10-11,15-16,18-19,21H,3-5,9,12-14H2,1-2H3/t18-,19+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309049
PNG
((3R,4S)-N-[(2,5-dichlorothiophen-3-yl)methyl]-1-[(...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](NCc2cc(Cl)sc2Cl)[C@H](C1)c1ccccc1
Show InChI InChI=1S/C19H20Cl2N4O2S2/c1-24-11-18(23-12-24)29(26,27)25-9-15(13-5-3-2-4-6-13)16(10-25)22-8-14-7-17(20)28-19(14)21/h2-7,11-12,15-16,22H,8-10H2,1H3/t15-,16+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM309095
PNG
(5-chloro-N-{(3R,4S)-4-(4-fluorophenyl)-1-[(1-methy...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1C[C@H](Nc2cc(c(Cl)cn2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1
Show InChI InChI=1S/C20H18ClF4N5O2S/c1-29-10-19(27-11-29)33(31,32)30-8-14(12-2-4-13(22)5-3-12)17(9-30)28-18-6-15(20(23,24)25)16(21)7-26-18/h2-7,10-11,14,17H,8-9H2,1H3,(H,26,28)/t14-,17+/m1/s1
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AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding assays using recombinant CHO cell membranes expressing human GlyT1: Radioligand binding to human GlyT1c transporter-expressing me...


US Patent US9656955 (2017)


BindingDB Entry DOI: 10.7270/Q2Z60R48
More data for this
Ligand-Target Pair
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