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Compile Data Set for Download or QSAR

Found 872 hits Enz. Inhib. hit(s) with Target = 'Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase'   
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))
BDBM50433270
PNG
(CHEMBL2376329)
Show SMILES CCC1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccc(OC)cc1
Show InChI InChI=1/C19H21N3O5S/c1-4-19(2)18(24)20-16-10-9-14(11-15(16)17(23)21-19)28(25,26)22-12-5-7-13(27-3)8-6-12/h5-11,22H,4H2,1-3H3,(H,20,24)(H,21,23)
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n/an/a 32n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MGAT1 expressed in insect cell membrane using 2-oleyl-sn-glycerol and [14C]-oleyl-coenzyme A as substrate after 10 to...


Bioorg Med Chem Lett 23: 2721-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.084
BindingDB Entry DOI: 10.7270/Q2GB25DM
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM50433272
PNG
(CHEMBL2376325)
Show SMILES CCC1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1/C18H18ClN3O4S/c1-3-18(2)17(24)20-15-9-8-13(10-14(15)16(23)21-18)27(25,26)22-12-6-4-11(19)5-7-12/h4-10,22H,3H2,1-2H3,(H,20,24)(H,21,23)
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n/an/a 50n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MGAT1 expressed in insect cell membrane using 2-oleyl-sn-glycerol and [14C]-oleyl-coenzyme A as substrate after 10 to...


Bioorg Med Chem Lett 23: 2721-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.084
BindingDB Entry DOI: 10.7270/Q2GB25DM
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM50433274
PNG
(CHEMBL2376321)
Show SMILES CC[C@]1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccc(OC(F)F)cc1
Show InChI InChI=1/C19H19F2N3O5S/c1-3-19(2)17(26)22-15-9-8-13(10-14(15)16(25)23-19)30(27,28)24-11-4-6-12(7-5-11)29-18(20)21/h4-10,18,24H,3H2,1-2H3,(H,22,26)(H,23,25)/t19-/s2
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n/an/a 63n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MGAT1 expressed in insect cell membrane using 2-oleyl-sn-glycerol and [14C]-oleyl-coenzyme A as substrate after 10 to...


Bioorg Med Chem Lett 23: 2721-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.084
BindingDB Entry DOI: 10.7270/Q2GB25DM
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM50433271
PNG
(CHEMBL2376327)
Show SMILES CCC1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccccc1Cl
Show InChI InChI=1/C18H18ClN3O4S/c1-3-18(2)17(24)20-14-9-8-11(10-12(14)16(23)21-18)27(25,26)22-15-7-5-4-6-13(15)19/h4-10,22H,3H2,1-2H3,(H,20,24)(H,21,23)
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n/an/a 158n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MGAT1 expressed in insect cell membrane using 2-oleyl-sn-glycerol and [14C]-oleyl-coenzyme A as substrate after 10 to...


Bioorg Med Chem Lett 23: 2721-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.084
BindingDB Entry DOI: 10.7270/Q2GB25DM
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM50433278
PNG
(CHEMBL2376312)
Show SMILES CCC1(C)NC(=O)c2cc(ccc2N(C)C1=O)S(=O)(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1/C19H20ClN3O4S/c1-4-19(2)18(25)23(3)16-10-9-14(11-15(16)17(24)21-19)28(26,27)22-13-7-5-12(20)6-8-13/h5-11,22H,4H2,1-3H3,(H,21,24)
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n/an/a 398n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MGAT1 expressed in insect cell membrane using 2-oleyl-sn-glycerol and [14C]-oleyl-coenzyme A as substrate after 10 to...


Bioorg Med Chem Lett 23: 2721-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.084
BindingDB Entry DOI: 10.7270/Q2GB25DM
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM50433273
PNG
(CHEMBL2376322)
Show SMILES CCC1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccccc1
Show InChI InChI=1/C18H19N3O4S/c1-3-18(2)17(23)19-15-10-9-13(11-14(15)16(22)20-18)26(24,25)21-12-7-5-4-6-8-12/h4-11,21H,3H2,1-2H3,(H,19,23)(H,20,22)
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n/an/a 501n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MGAT1 expressed in insect cell membrane using 2-oleyl-sn-glycerol and [14C]-oleyl-coenzyme A as substrate after 10 to...


Bioorg Med Chem Lett 23: 2721-6 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.084
BindingDB Entry DOI: 10.7270/Q2GB25DM
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM50117665
PNG
(CHEMBL3613709)
Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCC2)c1
Show InChI InChI=1S/C23H25N5O4S/c1-32-20-7-2-4-16(10-20)11-23(29)27-14-17-8-9-21(12-18(17)15-27)33(30,31)26-22-13-24-28(25-22)19-5-3-6-19/h2,4,7-10,12-13,19H,3,5-6,11,14-15H2,1H3,(H,25,26)
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n/an/a 1.48E+4n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of MGAT1 (unknown origin) assessed as effect on incorporation of [1-14C]decanoyl moiety into DAG using [1-14C]decanoyl-CoA and 2-oleoylgly...


J Med Chem 58: 7164-72 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01008
BindingDB Entry DOI: 10.7270/Q2F191HJ
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM50117665
PNG
(CHEMBL3613709)
Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCC2)c1
Show InChI InChI=1S/C23H25N5O4S/c1-32-20-7-2-4-16(10-20)11-23(29)27-14-17-8-9-21(12-18(17)15-27)33(30,31)26-22-13-24-28(25-22)19-5-3-6-19/h2,4,7-10,12-13,19H,3,5-6,11,14-15H2,1H3,(H,25,26)
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n/an/a 1.49E+4n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of MGAT1 (unknown origin) assessed as effect on incorporation of [1-14C]decanoyl moiety into DAG using [1-14C]decanoyl-CoA and 2-oleoylgly...


J Med Chem 58: 7164-72 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01008
BindingDB Entry DOI: 10.7270/Q2F191HJ
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM50117659
PNG
(CHEMBL3613703)
Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)NCCc2cccc(F)c2)c1
Show InChI InChI=1S/C25H25FN2O4S/c1-32-23-7-3-5-19(13-23)14-25(29)28-16-20-8-9-24(15-21(20)17-28)33(30,31)27-11-10-18-4-2-6-22(26)12-18/h2-9,12-13,15,27H,10-11,14,16-17H2,1H3
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n/an/a>4.00E+4n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of MGAT1 (unknown origin) assessed as effect on incorporation of [1-14C]decanoyl moiety into DAG using [1-14C]decanoyl-CoA and 2-oleoylgly...


J Med Chem 58: 7164-72 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01008
BindingDB Entry DOI: 10.7270/Q2F191HJ
More data for this
Ligand-Target Pair
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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<1n/an/an/an/an/an/an/an/a



AbbVie Inc

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)


Article DOI: 10.1021/jm050458h
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

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)


Article DOI: 10.1021/jm050458h
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

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)


Article DOI: 10.1021/jm050458h
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

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)


Article DOI: 10.1021/jm050458h
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

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)


Article DOI: 10.1021/jm050458h
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

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)


Article DOI: 10.1021/jm050458h
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

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)


Article DOI: 10.1021/jm050458h
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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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)


Article DOI: 10.1021/jm050458h
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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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)


Article DOI: 10.1021/jm050458h
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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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)


Article DOI: 10.1021/jm050458h
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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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)


Article DOI: 10.1021/jm050458h
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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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)


Article DOI: 10.1021/jm050458h
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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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)


Article DOI: 10.1021/jm050458h
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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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)


Article DOI: 10.1021/jm050458h
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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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)


Article DOI: 10.1021/jm050458h
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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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)


Article DOI: 10.1021/jm050458h
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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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)


Article DOI: 10.1021/jm050458h
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))
BDBM294256
PNG
(Cis-N-(1-(4-benzyl-3-(methylamino)chroman-6-yl)aze...)
Show SMILES CNC1COc2ccc(cc2C1Cc1ccccc1)N1CC(C1)NS(=O)(=O)CC1CC1
Show InChI InChI=1/C24H31N3O3S/c1-25-23-15-30-24-10-9-20(12-22(24)21(23)11-17-5-3-2-4-6-17)27-13-19(14-27)26-31(28,29)16-18-7-8-18/h2-6,9-10,12,18-19,21,23,25-26H,7-8,11,13-16H2,1H3
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294276
PNG
(Cis-N-(1-(4-benzyl-7-fluoro-3-(methylamino)chroman...)
Show SMILES CCCS(=O)(=O)NC1CN(C1)c1cc2C(Cc3ccccc3)C(COc2cc1F)NC
Show InChI InChI=1/C23H30FN3O3S/c1-3-9-31(28,29)26-17-13-27(14-17)22-11-19-18(10-16-7-5-4-6-8-16)21(25-2)15-30-23(19)12-20(22)24/h4-8,11-12,17-18,21,25-26H,3,9-10,13-15H2,1-2H3
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294227
PNG
(US9586942, 1)
Show SMILES Cn1cnc(c1)S(=O)(=O)NC1CN(C1)c1ccc2CC[C@@H]([C@H](Cc3ccccc3)c2c1)N1CCC1
Show InChI InChI=1S/C27H33N5O2S/c1-30-18-27(28-19-30)35(33,34)29-22-16-32(17-22)23-10-8-21-9-11-26(31-12-5-13-31)25(24(21)15-23)14-20-6-3-2-4-7-20/h2-4,6-8,10,15,18-19,22,25-26,29H,5,9,11-14,16-17H2,1H3/t25-,26+/m1/s1
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Assay Description
Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,000 cells per well in 96 well Cytostar-T scintillation microplates (Amersha...


US Patent US9586942 (2017)


Article DOI: 10.1016/j.bmcl.2005.01.052
BindingDB Entry DOI: 10.7270/Q20Z75BG
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294228
PNG
(N-(1-((7S,8R)-7-(azetidin-1-yl)-8-benzyl-5,6,7,8-t...)
Show SMILES Cn1cnc(c1)S(=O)(=O)NC1CN(C1)c1ccc2CC[C@@H]([C@H](Cc3ccccc3)c2c1)N1CCC1
Show InChI InChI=1/C27H33N5O2S/c1-30-18-27(28-19-30)35(33,34)29-22-16-32(17-22)23-10-8-21-9-11-26(31-12-5-13-31)25(24(21)15-23)14-20-6-3-2-4-7-20/h2-4,6-8,10,15,18-19,22,25-26,29H,5,9,11-14,16-17H2,1H3/t25-,26+/s2
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Assay Description
Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,000 cells per well in 96 well Cytostar-T scintillation microplates (Amersha...


US Patent US9586942 (2017)


Article DOI: 10.1016/j.bmcl.2005.01.052
BindingDB Entry DOI: 10.7270/Q20Z75BG
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294231
PNG
(US9586942, 5*)
Show SMILES CCCS(=O)(=O)NC1CN(C1)c1ccc2CC[C@@H]([C@H](Cc3ccccc3)c2c1)N1CCC1
Show InChI InChI=1S/C26H35N3O2S/c1-2-15-32(30,31)27-22-18-29(19-22)23-11-9-21-10-12-26(28-13-6-14-28)25(24(21)17-23)16-20-7-4-3-5-8-20/h3-5,7-9,11,17,22,25-27H,2,6,10,12-16,18-19H2,1H3/t25-,26+/m1/s1
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Assay Description
Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,000 cells per well in 96 well Cytostar-T scintillation microplates (Amersha...


US Patent US9586942 (2017)


Article DOI: 10.1016/j.bmcl.2005.01.052
BindingDB Entry DOI: 10.7270/Q20Z75BG
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294238
PNG
(N-((1R,3r)-3-((7S,8R)-7-(azetidin-1-yl)-8-benzyl-5...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N[C@H]1C[C@@H](C1)c1ccc2CC[C@@H]([C@H](Cc3ccccc3)c2c1)N1CCC1
Show InChI InChI=1/C28H34N4O2S/c1-31-18-28(29-19-31)35(33,34)30-24-15-23(16-24)22-9-8-21-10-11-27(32-12-5-13-32)26(25(21)17-22)14-20-6-3-2-4-7-20/h2-4,6-9,17-19,23-24,26-27,30H,5,10-16H2,1H3/t23-,24-,26-,27+/s2
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Assay Description
Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,000 cells per well in 96 well Cytostar-T scintillation microplates (Amersha...


US Patent US9586942 (2017)


Article DOI: 10.1016/j.bmcl.2005.01.052
BindingDB Entry DOI: 10.7270/Q20Z75BG
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294242
PNG
(N-(1-((7S,8R)-8-benzyl-7-(3-azabicyclo[3.1.0]hexan...)
Show SMILES Cn1cc(nn1)S(=O)(=O)NC1CN(C1)c1ccc2CC[C@@H]([C@H](Cc3ccccc3)c2c1)N1CC2CC2C1
Show InChI InChI=1/C28H34N6O2S/c1-32-18-28(29-31-32)37(35,36)30-23-16-33(17-23)24-9-7-20-8-10-27(34-14-21-12-22(21)15-34)26(25(20)13-24)11-19-5-3-2-4-6-19/h2-7,9,13,18,21-23,26-27,30H,8,10-12,14-17H2,1H3/t21?,22?,26-,27+/s2
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Assay Description
Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,000 cells per well in 96 well Cytostar-T scintillation microplates (Amersha...


US Patent US9586942 (2017)


Article DOI: 10.1016/j.bmcl.2005.01.052
BindingDB Entry DOI: 10.7270/Q20Z75BG
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294243
PNG
(N-(1-((7S,8R)-8-benzyl-7-(3-azabicyclo[3.1.0]hexan...)
Show SMILES CCCS(=O)(=O)NC1CN(C1)c1ccc2CC[C@@H]([C@H](Cc3ccccc3)c2c1)N1CC2CC2C1
Show InChI InChI=1S/C28H37N3O2S/c1-2-12-34(32,33)29-24-18-30(19-24)25-10-8-21-9-11-28(31-16-22-14-23(22)17-31)27(26(21)15-25)13-20-6-4-3-5-7-20/h3-8,10,15,22-24,27-29H,2,9,11-14,16-19H2,1H3/t22?,23?,27-,28+/m1/s1
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Assay Description
Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,000 cells per well in 96 well Cytostar-T scintillation microplates (Amersha...


US Patent US9586942 (2017)


Article DOI: 10.1016/j.bmcl.2005.01.052
BindingDB Entry DOI: 10.7270/Q20Z75BG
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294244
PNG
( N-[1-[3-(azetidin-1-yl)-4-benzyl-chroman-6-yl]aze...)
Show SMILES Cn1cnc(c1)S(=O)(=O)NC1CN(C1)c1ccc2OCC(C(Cc3ccccc3)c2c1)N1CCC1
Show InChI InChI=1/C26H31N5O3S/c1-29-16-26(27-18-29)35(32,33)28-20-14-31(15-20)21-8-9-25-23(13-21)22(12-19-6-3-2-4-7-19)24(17-34-25)30-10-5-11-30/h2-4,6-9,13,16,18,20,22,24,28H,5,10-12,14-15,17H2,1H3
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294249
PNG
(Cis-N-(1-(3-(azetidin-1-yl)-4-benzylchroman-6-yl)a...)
Show SMILES Cn1cc(nn1)S(=O)(=O)NC1CN(C1)c1ccc2OCC(C(Cc3ccccc3)c2c1)N1CCC1
Show InChI InChI=1/C25H30N6O3S/c1-29-16-25(26-28-29)35(32,33)27-19-14-31(15-19)20-8-9-24-22(13-20)21(12-18-6-3-2-4-7-18)23(17-34-24)30-10-5-11-30/h2-4,6-9,13,16,19,21,23,27H,5,10-12,14-15,17H2,1H3
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294254
PNG
(Cis-N-(1-(4-benzyl-3-(methylamino)chroman-6-yl)aze...)
Show SMILES CCCS(=O)(=O)NC1CN(C1)c1ccc2OCC(NC)C(Cc3ccccc3)c2c1
Show InChI InChI=1/C23H31N3O3S/c1-3-11-30(27,28)25-18-14-26(15-18)19-9-10-23-21(13-19)20(22(24-2)16-29-23)12-17-7-5-4-6-8-17/h4-10,13,18,20,22,24-25H,3,11-12,14-16H2,1-2H3
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294256
PNG
(Cis-N-(1-(4-benzyl-3-(methylamino)chroman-6-yl)aze...)
Show SMILES CNC1COc2ccc(cc2C1Cc1ccccc1)N1CC(C1)NS(=O)(=O)CC1CC1
Show InChI InChI=1/C24H31N3O3S/c1-25-23-15-30-24-10-9-20(12-22(24)21(23)11-17-5-3-2-4-6-17)27-13-19(14-27)26-31(28,29)16-18-7-8-18/h2-6,9-10,12,18-19,21,23,25-26H,7-8,11,13-16H2,1H3
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294259
PNG
( Cis-N-(1-(4-benzyl-7-fluoro-3-(methylamino)chroma...)
Show SMILES CN[C@@H]1COc2cc(F)c(cc2[C@@H]1Cc1ccccc1)N1CC(C1)NS(=O)(=O)c1cn(C)cn1
Show InChI InChI=1S/C24H28FN5O3S/c1-26-21-14-33-23-10-20(25)22(9-19(23)18(21)8-16-6-4-3-5-7-16)30-11-17(12-30)28-34(31,32)24-13-29(2)15-27-24/h3-7,9-10,13,15,17-18,21,26,28H,8,11-12,14H2,1-2H3/t18-,21+/m0/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294260
PNG
(US9586945, 15b | trans-N-(1-(4-benzyl-7-fluoro-3-(...)
Show SMILES CN[C@@H]1COc2cc(F)c(cc2[C@H]1Cc1ccccc1)N1CC(C1)NS(=O)(=O)c1cn(C)cn1
Show InChI InChI=1S/C24H28FN5O3S/c1-26-21-14-33-23-10-20(25)22(9-19(23)18(21)8-16-6-4-3-5-7-16)30-11-17(12-30)28-34(31,32)24-13-29(2)15-27-24/h3-7,9-10,13,15,17-18,21,26,28H,8,11-12,14H2,1-2H3/t18-,21-/m1/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294261
PNG
( Cis-N-(1-(4-benzyl-7-fluoro-3-(methylamino)chroma...)
Show SMILES CCCS(=O)(=O)NC1CN(C1)c1cc2[C@H](Cc3ccccc3)[C@@H](COc2cc1F)NC
Show InChI InChI=1S/C23H30FN3O3S/c1-3-9-31(28,29)26-17-13-27(14-17)22-11-19-18(10-16-7-5-4-6-8-16)21(25-2)15-30-23(19)12-20(22)24/h4-8,11-12,17-18,21,25-26H,3,9-10,13-15H2,1-2H3/t18-,21+/m0/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294262
PNG
(US9586945, 16b | trans-N-(1-(4-benzyl-7-fluoro-3-(...)
Show SMILES CCCS(=O)(=O)NC1CN(C1)c1cc2[C@@H](Cc3ccccc3)[C@@H](COc2cc1F)NC
Show InChI InChI=1S/C23H30FN3O3S/c1-3-9-31(28,29)26-17-13-27(14-17)22-11-19-18(10-16-7-5-4-6-8-16)21(25-2)15-30-23(19)12-20(22)24/h4-8,11-12,17-18,21,25-26H,3,9-10,13-15H2,1-2H3/t18-,21-/m1/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294263
PNG
( Cis-N-(1-(4-benzyl-7-fluoro-3-(methylamino)chroma...)
Show SMILES CN[C@@H]1COc2cc(F)c(cc2[C@@H]1Cc1ccccc1)N1CC(C1)NS(=O)(=O)c1cnn(C)c1
Show InChI InChI=1S/C24H28FN5O3S/c1-26-22-15-33-24-10-21(25)23(9-20(24)19(22)8-16-6-4-3-5-7-16)30-12-17(13-30)28-34(31,32)18-11-27-29(2)14-18/h3-7,9-11,14,17,19,22,26,28H,8,12-13,15H2,1-2H3/t19-,22+/m0/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294264
PNG
(US9586945, 17b | trans-N-(1-(4-benzyl-7-fluoro-3-(...)
Show SMILES CN[C@@H]1COc2cc(F)c(cc2[C@H]1Cc1ccccc1)N1CC(C1)NS(=O)(=O)c1cnn(C)c1
Show InChI InChI=1S/C24H28FN5O3S/c1-26-22-15-33-24-10-21(25)23(9-20(24)19(22)8-16-6-4-3-5-7-16)30-12-17(13-30)28-34(31,32)18-11-27-29(2)14-18/h3-7,9-11,14,17,19,22,26,28H,8,12-13,15H2,1-2H3/t19-,22-/m1/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294265
PNG
(Cis-N-(1-(4-benzyl-7-fluoro-3-(methylamino)chroman...)
Show SMILES CN[C@@H]1COc2cc(F)c(cc2[C@@H]1Cc1ccccc1)N1CC(C1)NS(=O)(=O)c1cn(C)nn1
Show InChI InChI=1S/C23H27FN6O3S/c1-25-20-14-33-22-10-19(24)21(9-18(22)17(20)8-15-6-4-3-5-7-15)30-11-16(12-30)27-34(31,32)23-13-29(2)28-26-23/h3-7,9-10,13,16-17,20,25,27H,8,11-12,14H2,1-2H3/t17-,20+/m0/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294266
PNG
(US9586945, 18b | trans-N-(1-(4-benzyl-7-fluoro-3-(...)
Show SMILES CN[C@@H]1COc2cc(F)c(cc2[C@H]1Cc1ccccc1)N1CC(C1)NS(=O)(=O)c1cn(C)nn1
Show InChI InChI=1S/C23H27FN6O3S/c1-25-20-14-33-22-10-19(24)21(9-18(22)17(20)8-15-6-4-3-5-7-15)30-11-16(12-30)27-34(31,32)23-13-29(2)28-26-23/h3-7,9-10,13,16-17,20,25,27H,8,11-12,14H2,1-2H3/t17-,20-/m1/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294267
PNG
( Cis-N-(1-(4-benzyl-7-fluoro-3-(methylamino)chroma...)
Show SMILES CN[C@@H]1COc2cc(F)c(cc2[C@@H]1Cc1ccccc1)N1CC(C1)NS(=O)(=O)CC1CC1
Show InChI InChI=1S/C24H30FN3O3S/c1-26-22-14-31-24-11-21(25)23(10-20(24)19(22)9-16-5-3-2-4-6-16)28-12-18(13-28)27-32(29,30)15-17-7-8-17/h2-6,10-11,17-19,22,26-27H,7-9,12-15H2,1H3/t19-,22+/m0/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294268
PNG
( trans-N-(1-(4-benzyl-7-fluoro-3-(methylamino)chro...)
Show SMILES CN[C@@H]1COc2cc(F)c(cc2[C@H]1Cc1ccccc1)N1CC(C1)NS(=O)(=O)CC1CC1
Show InChI InChI=1S/C24H30FN3O3S/c1-26-22-14-31-24-11-21(25)23(10-20(24)19(22)9-16-5-3-2-4-6-16)28-12-18(13-28)27-32(29,30)15-17-7-8-17/h2-6,10-11,17-19,22,26-27H,7-9,12-15H2,1H3/t19-,22-/m1/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294270
PNG
(US9586945, 21)
Show SMILES N[C@@H]1COc2ccc(cc2[C@@H]1Cc1ccccc1)N1CC(C1)NS(=O)(=O)CC1CC1
Show InChI InChI=1S/C23H29N3O3S/c24-22-14-29-23-9-8-19(11-21(23)20(22)10-16-4-2-1-3-5-16)26-12-18(13-26)25-30(27,28)15-17-6-7-17/h1-5,8-9,11,17-18,20,22,25H,6-7,10,12-15,24H2/t20-,22+/m0/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM294271
PNG
( Cis-N-(1-(4-benzyl-3-(methylamino)chroman-6-yl)az...)
Show SMILES CCCS(=O)(=O)NC1CN(C1)c1ccc2OC[C@@H](NC)[C@@H](Cc3ccccc3)c2c1
Show InChI InChI=1S/C23H31N3O3S/c1-3-11-30(27,28)25-18-14-26(15-18)19-9-10-23-21(13-19)20(22(24-2)16-29-23)12-17-7-5-4-6-8-17/h4-10,13,18,20,22,24-25H,3,11-12,14-16H2,1-2H3/t20-,22+/m0/s1
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Assay Description
1. [3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,0...


US Patent US9586945 (2017)


Article DOI: 10.1016/j.bmcl.2004.09.053
BindingDB Entry DOI: 10.7270/Q2W66NTN
More data for this
Ligand-Target Pair
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