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Patent code US9611275

Compile Data Set for Download or QSAR
Found 61 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
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314813
PNG
((3aR,5S,6S,7R,7aR)-5-((R)-1-(4- benzylbenzyloxy)-2...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(Cc4ccccc4)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C23H25F3N2O4S/c1-27-22-28-16-17(29)18(30)19(32-21(16)33-22)20(23(24,25)26)31-12-15-9-7-14(8-10-15)11-13-5-3-2-4-6-13/h2-10,16-21,29-30H,11-12H2,1H3,(H,27,28)/t16-,17-,18+,19+,20-,21-/m1/s1
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US Patent
0.160n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314809
PNG
((3aR,5S,6S,7R,7aR)-2-(dimethylamino)-5-((R)-1-meth...)
Show SMILES CO[C@H](C)[C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C
Show InChI InChI=1S/C11H20N2O4S/c1-5(16-4)9-8(15)7(14)6-10(17-9)18-11(12-6)13(2)3/h5-10,14-15H,1-4H3/t5-,6-,7-,8+,9-,10-/m1/s1
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US Patent
0.190n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314781
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES COc1c(C)cc(CO[C@H]([C@H]2O[C@@H]3SC(=N[C@@H]3[C@@H](O)[C@@H]2O)N(C)C)C(F)(F)F)cc1C
Show InChI InChI=1S/C20H27F3N2O5S/c1-9-6-11(7-10(2)15(9)28-5)8-29-17(20(21,22)23)16-14(27)13(26)12-18(30-16)31-19(24-12)25(3)4/h6-7,12-14,16-18,26-27H,8H2,1-5H3/t12-,13-,14+,16+,17-,18-/m1/s1
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0.450n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314796
PNG
((3aR,5S,6S,7R,7aR)-2- (methylamino)-5-((R)-2,2,2- ...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(CCCF)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C19H24F4N2O4S/c1-24-18-25-12-13(26)14(27)15(29-17(12)30-18)16(19(21,22)23)28-9-11-6-4-10(5-7-11)3-2-8-20/h4-7,12-17,26-27H,2-3,8-9H2,1H3,(H,24,25)/t12-,13-,14+,15+,16-,17-/m1/s1
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0.590n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314787
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(CCF)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C19H24F4N2O4S/c1-25(2)18-24-12-13(26)14(27)15(29-17(12)30-18)16(19(21,22)23)28-9-11-5-3-10(4-6-11)7-8-20/h3-6,12-17,26-27H,7-9H2,1-2H3/t12-,13-,14+,15+,16-,17-/m1/s1
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0.610n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314778
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(OCCF)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C19H24F4N2O5S/c1-25(2)18-24-12-13(26)14(27)15(30-17(12)31-18)16(19(21,22)23)29-9-10-3-5-11(6-4-10)28-8-7-20/h3-6,12-17,26-27H,7-9H2,1-2H3/t12-,13-,14+,15+,16-,17-/m1/s1
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0.650n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314794
PNG
((3aR,5S,6S,7R,7aR)-2- (methylamino)-5-((R)-2,2,2- ...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(CCF)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C18H22F4N2O4S/c1-23-17-24-11-12(25)13(26)14(28-16(11)29-17)15(18(20,21)22)27-8-10-4-2-9(3-5-10)6-7-19/h2-5,11-16,25-26H,6-8H2,1H3,(H,23,24)/t11-,12-,13+,14+,15-,16-/m1/s1
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0.710n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314788
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(CCCF)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C20H26F4N2O4S/c1-26(2)19-25-13-14(27)15(28)16(30-18(13)31-19)17(20(22,23)24)29-10-12-7-5-11(6-8-12)4-3-9-21/h5-8,13-18,27-28H,3-4,9-10H2,1-2H3/t13-,14-,15+,16+,17-,18-/m1/s1
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0.780n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314750
PNG
((3aR,5S,6S,7R,7aR)-5-((R)-1-(4-(allyloxy)benzyloxy...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(OCC=C)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C20H25F3N2O5S/c1-4-9-28-12-7-5-11(6-8-12)10-29-17(20(21,22)23)16-15(27)14(26)13-18(30-16)31-19(24-13)25(2)3/h4-8,13-18,26-27H,1,9-10H2,2-3H3/t13-,14-,15+,16+,17-,18-/m1/s1
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0.820n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314780
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES COc1ccc(CO[C@H]([C@H]2O[C@@H]3SC(=N[C@@H]3[C@@H](O)[C@@H]2O)N(C)C)C(F)(F)F)cc1C(F)(F)F
Show InChI InChI=1S/C19H22F6N2O5S/c1-27(2)17-26-11-12(28)13(29)14(32-16(11)33-17)15(19(23,24)25)31-7-8-4-5-10(30-3)9(6-8)18(20,21)22/h4-6,11-16,28-29H,7H2,1-3H3/t11-,12-,13+,14+,15-,16-/m1/s1
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0.840n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314812
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((S)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@H](OCc3ccccc3F)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C17H20F4N2O4S/c1-23(2)16-22-10-11(24)12(25)13(27-15(10)28-16)14(17(19,20)21)26-7-8-5-3-4-6-9(8)18/h3-6,10-15,24-25H,7H2,1-2H3/t10-,11-,12+,13+,14+,15-/m1/s1
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0.960n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314784
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((S)-1-eth...)
Show SMILES CCO[C@@H]([C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C)C(F)(F)F
Show InChI InChI=1S/C12H19F3N2O4S/c1-4-20-9(12(13,14)15)8-7(19)6(18)5-10(21-8)22-11(16-5)17(2)3/h5-10,18-19H,4H2,1-3H3/t5-,6-,7+,8+,9+,10-/m1/s1
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1.02n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314803
PNG
((3aR,5S,6S,7R,7aR)-2- (methylamino)-5-((R)-2,2,2- ...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(C)nc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C16H20F3N3O4S/c1-7-3-4-8(5-21-7)6-25-13(16(17,18)19)12-11(24)10(23)9-14(26-12)27-15(20-2)22-9/h3-5,9-14,23-24H,6H2,1-2H3,(H,20,22)/t9-,10-,11+,12+,13-,14-/m1/s1
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1.06n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314779
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(Oc4ccccc4)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C23H25F3N2O5S/c1-28(2)22-27-16-17(29)18(30)19(33-21(16)34-22)20(23(24,25)26)31-12-13-8-10-15(11-9-13)32-14-6-4-3-5-7-14/h3-11,16-21,29-30H,12H2,1-2H3/t16-,17-,18+,19+,20-,21-/m1/s1
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1.11n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314786
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(CF)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C18H22F4N2O4S/c1-24(2)17-23-11-12(25)13(26)14(28-16(11)29-17)15(18(20,21)22)27-8-10-5-3-9(7-19)4-6-10/h3-6,11-16,25-26H,7-8H2,1-2H3/t11-,12-,13+,14+,15-,16-/m1/s1
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1.13n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314815
PNG
((3aR,5S,6S,7R,7aR)-2- (methylamino)-5-((S)-1,1,1- ...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@@H]([C@@H](O)[C@@H]2O)[C@](C)(O)C(F)(F)F)S1
Show InChI InChI=1S/C10H15F3N2O4S/c1-9(18,10(11,12)13)6-5(17)4(16)3-7(19-6)20-8(14-2)15-3/h3-7,16-18H,1-2H3,(H,14,15)/t3-,4-,5+,6+,7-,9+/m1/s1
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1.29n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314783
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((S)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@H](OCc3cccc(F)c3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C17H20F4N2O4S/c1-23(2)16-22-10-11(24)12(25)13(27-15(10)28-16)14(17(19,20)21)26-7-8-4-3-5-9(18)6-8/h3-6,10-15,24-25H,7H2,1-2H3/t10-,11-,12+,13+,14+,15-/m1/s1
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1.32n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314776
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES COc1ccc(CO[C@H]([C@H]2O[C@@H]3SC(=N[C@@H]3[C@@H](O)[C@@H]2O)N(C)C)C(F)(F)F)cc1C
Show InChI InChI=1S/C19H25F3N2O5S/c1-9-7-10(5-6-11(9)27-4)8-28-16(19(20,21)22)15-14(26)13(25)12-17(29-15)30-18(23-12)24(2)3/h5-7,12-17,25-26H,8H2,1-4H3/t12-,13-,14+,15+,16-,17-/m1/s1
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1.35n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314775
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES COc1ccc(CO[C@H]([C@H]2O[C@@H]3SC(=N[C@@H]3[C@@H](O)[C@@H]2O)N(C)C)C(F)(F)F)cc1
Show InChI InChI=1S/C18H23F3N2O5S/c1-23(2)17-22-11-12(24)13(25)14(28-16(11)29-17)15(18(19,20)21)27-8-9-4-6-10(26-3)7-5-9/h4-7,11-16,24-25H,8H2,1-3H3/t11-,12-,13+,14+,15-,16-/m1/s1
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1.38n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314797
PNG
((3aR,5S,6S,7R,7aR)-2- (methylamino)-5-((R)-2,2,2- ...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(F)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C16H18F4N2O4S/c1-21-15-22-9-10(23)11(24)12(26-14(9)27-15)13(16(18,19)20)25-6-7-2-4-8(17)5-3-7/h2-5,9-14,23-24H,6H2,1H3,(H,21,22)/t9-,10-,11+,12+,13-,14-/m1/s1
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1.44n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314772
PNG
((3aR,5S,6S,7R,7aR)-5-((R)-1- (2,3-difluorobenzylox...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3cccc(F)c3F)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C17H19F5N2O4S/c1-24(2)16-23-10-11(25)12(26)13(28-15(10)29-16)14(17(20,21)22)27-6-7-4-3-5-8(18)9(7)19/h3-5,10-15,25-26H,6H2,1-2H3/t10-,11-,12+,13+,14-,15-/m1/s1
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1.44n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314792
PNG
((3aR,5S,6S,7R,7aR)-5-((R)-1-(2- cyclohexylethoxy)-...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@@H](OCCC3CCCCC3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C17H27F3N2O4S/c1-21-16-22-10-11(23)12(24)13(26-15(10)27-16)14(17(18,19)20)25-8-7-9-5-3-2-4-6-9/h9-15,23-24H,2-8H2,1H3,(H,21,22)/t10-,11-,12+,13+,14-,15-/m1/s1
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1.49n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314766
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCCCc3ccc(F)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C19H24F4N2O4S/c1-25(2)18-24-12-13(26)14(27)15(29-17(12)30-18)16(19(21,22)23)28-9-3-4-10-5-7-11(20)8-6-10/h5-8,12-17,26-27H,3-4,9H2,1-2H3/t12-,13-,14+,15+,16-,17-/m1/s1
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1.52n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314745
PNG
((3aR,5S,6S,7R,7aR)-2-(dimethylamino)-5-((R)-2,2,2-...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](Oc3ccc(cc3)[N+]([O-])=O)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C16H18F3N3O6S/c1-21(2)15-20-9-10(23)11(24)12(28-14(9)29-15)13(16(17,18)19)27-8-5-3-7(4-6-8)22(25)26/h3-6,9-14,23-24H,1-2H3/t9-,10-,11+,12+,13-,14-/m1/s1
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1.79n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314771
PNG
((3aR,5S,6S,7R,7aR)-5-((R)-1-(4- benzylbenzyloxy)-2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(Cc4ccccc4)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C24H27F3N2O4S/c1-29(2)23-28-17-18(30)19(31)20(33-22(17)34-23)21(24(25,26)27)32-13-16-10-8-15(9-11-16)12-14-6-4-3-5-7-14/h3-11,17-22,30-31H,12-13H2,1-2H3/t17-,18-,19+,20+,21-,22-/m1/s1
PDB

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1.97n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314782
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccccc3F)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C17H20F4N2O4S/c1-23(2)16-22-10-11(24)12(25)13(27-15(10)28-16)14(17(19,20)21)26-7-8-5-3-4-6-9(8)18/h3-6,10-15,24-25H,7H2,1-2H3/t10-,11-,12+,13+,14-,15-/m1/s1
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1.98n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314762
PNG
((3aR,5S,6S,7R,7aR)-5-((R)-1-(2- cyclohexylethoxy)-...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCCC3CCCCC3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C18H29F3N2O4S/c1-23(2)17-22-11-12(24)13(25)14(27-16(11)28-17)15(18(19,20)21)26-9-8-10-6-4-3-5-7-10/h10-16,24-25H,3-9H2,1-2H3/t11-,12-,13+,14+,15-,16-/m1/s1
PDB

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2.27n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314785
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(cc3)C(F)(F)F)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C18H20F6N2O4S/c1-26(2)16-25-10-11(27)12(28)13(30-15(10)31-16)14(18(22,23)24)29-7-8-3-5-9(6-4-8)17(19,20)21/h3-6,10-15,27-28H,7H2,1-2H3/t10-,11-,12+,13+,14-,15-/m1/s1
PDB

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2.32n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314769
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3cccnc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C16H20F3N3O4S/c1-22(2)15-21-9-10(23)11(24)12(26-14(9)27-15)13(16(17,18)19)25-7-8-4-3-5-20-6-8/h3-6,9-14,23-24H,7H2,1-2H3/t9-,10-,11+,12+,13-,14-/m1/s1
PDB

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2.36n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314767
PNG
((3aR,5S,6S,7R,7aR)-5-((R)-1- (benzyloxy)-2,2,2-tri...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccccc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C17H21F3N2O4S/c1-22(2)16-21-10-11(23)12(24)13(26-15(10)27-16)14(17(18,19)20)25-8-9-6-4-3-5-7-9/h3-7,10-15,23-24H,8H2,1-2H3/t10-,11-,12+,13+,14-,15-/m1/s1
PDB

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2.43n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314758
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCCCCF)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C14H22F4N2O4S/c1-20(2)13-19-7-8(21)9(22)10(24-12(7)25-13)11(14(16,17)18)23-6-4-3-5-15/h7-12,21-22H,3-6H2,1-2H3/t7-,8-,9+,10+,11-,12-/m1/s1
PDB

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2.85n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314770
PNG
((3aR,5S,6S,7R,7aR)-5-((R)-1- (biphenyl-4-ylmethoxy...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(cc3)-c3ccccc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C23H25F3N2O4S/c1-28(2)22-27-16-17(29)18(30)19(32-21(16)33-22)20(23(24,25)26)31-12-13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-11,16-21,29-30H,12H2,1-2H3/t16-,17-,18+,19+,20-,21-/m1/s1
PDB

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3.05n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314793
PNG
((3aR,5S,6S,7R,7aR)-2- (methylamino)-5-((R)-2,2,2- ...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(C)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C17H21F3N2O4S/c1-8-3-5-9(6-4-8)7-25-14(17(18,19)20)13-12(24)11(23)10-15(26-13)27-16(21-2)22-10/h3-6,10-15,23-24H,7H2,1-2H3,(H,21,22)/t10-,11-,12+,13+,14-,15-/m1/s1
PDB

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3.11n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314752
PNG
(US9611275, Example 21)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(O)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C17H21F3N2O5S/c1-22(2)16-21-10-11(24)12(25)13(27-15(10)28-16)14(17(18,19)20)26-7-8-3-5-9(23)6-4-8/h3-6,10-15,23-25H,7H2,1-2H3/t10-,11-,12+,13+,14-,15-/m1/s1
PDB

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3.31n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314748
PNG
((3aR,5R,6S,7R,7aR)-5-((S)-1-amino-2,2,2-trifluoroe...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@H](N)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C10H16F3N3O3S/c1-16(2)9-15-3-4(17)5(18)6(19-8(3)20-9)7(14)10(11,12)13/h3-8,17-18H,14H2,1-2H3/t3-,4-,5+,6+,7+,8-/m1/s1
PDB

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3.69n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314791
PNG
((3aR,5S,6S,7R,7aR)-2- (methylamino)-5-((R)-2,2,2- ...)
Show SMILES CCCO[C@H]([C@H]1O[C@@H]2SC(NC)=N[C@@H]2[C@@H](O)[C@@H]1O)C(F)(F)F
Show InChI InChI=1S/C12H19F3N2O4S/c1-3-4-20-9(12(13,14)15)8-7(19)6(18)5-10(21-8)22-11(16-2)17-5/h5-10,18-19H,3-4H2,1-2H3,(H,16,17)/t5-,6-,7+,8+,9-,10-/m1/s1
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3.77n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314754
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CCCCCO[C@H]([C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C)C(F)(F)F
Show InChI InChI=1S/C15H25F3N2O4S/c1-4-5-6-7-23-12(15(16,17)18)11-10(22)9(21)8-13(24-11)25-14(19-8)20(2)3/h8-13,21-22H,4-7H2,1-3H3/t8-,9-,10+,11+,12-,13-/m1/s1
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4.14n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314814
PNG
((3aR,5S,6S,7R,7aR)-5-((S)-1- methoxyethyl)-2-(meth...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@H](C)OC)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C10H18N2O4S/c1-4(15-3)8-7(14)6(13)5-9(16-8)17-10(11-2)12-5/h4-9,13-14H,1-3H3,(H,11,12)/t4-,5+,6+,7-,8+,9+/m0/s1
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4.26n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314804
PNG
((3aR,5S,6S,7R,7aR)-5-((R)-1-(4- aminophenoxy)-2,2,...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](Oc3ccc(N)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C16H20F3N3O4S/c1-22(2)15-21-9-10(23)11(24)12(26-14(9)27-15)13(16(17,18)19)25-8-5-3-7(20)4-6-8/h3-6,9-14,23-24H,20H2,1-2H3/t9-,10-,11+,12+,13-,14-/m1/s1
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4.29n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314743
PNG
((3aR,5S,6S,7R,7aR)-2-(methylamino)-5-((R)-2,2,2-tr...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@@H](Oc3ccc(cc3)[N+]([O-])=O)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C15H16F3N3O6S/c1-19-14-20-8-9(22)10(23)11(27-13(8)28-14)12(15(16,17)18)26-7-4-2-6(3-5-7)21(24)25/h2-5,8-13,22-23H,1H3,(H,19,20)/t8-,9-,10+,11+,12-,13-/m1/s1
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4.35n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314759
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCCCCCF)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C15H24F4N2O4S/c1-21(2)14-20-8-9(22)10(23)11(25-13(8)26-14)12(15(17,18)19)24-7-5-3-4-6-16/h8-13,22-23H,3-7H2,1-2H3/t8-,9-,10+,11+,12-,13-/m1/s1
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4.40n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314753
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CCCO[C@H]([C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C)C(F)(F)F
Show InChI InChI=1S/C13H21F3N2O4S/c1-4-5-21-10(13(14,15)16)9-8(20)7(19)6-11(22-9)23-12(17-6)18(2)3/h6-11,19-20H,4-5H2,1-3H3/t6-,7-,8+,9+,10-,11-/m1/s1
PDB

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4.5n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314715
PNG
((3aR,5S,6S,7R,7aR)-2-(dimethylamino)-5-((R)-2,2,2-...)
Show SMILES CO[C@H]([C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C)C(F)(F)F
Show InChI InChI=1S/C11H17F3N2O4S/c1-16(2)10-15-4-5(17)6(18)7(20-9(4)21-10)8(19-3)11(12,13)14/h4-9,17-18H,1-3H3/t4-,5-,6+,7+,8-,9-/m1/s1
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4.60n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314761
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCCN3CCOCC3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C16H26F3N3O5S/c1-21(2)15-20-9-10(23)11(24)12(27-14(9)28-15)13(16(17,18)19)26-8-5-22-3-6-25-7-4-22/h9-14,23-24H,3-8H2,1-2H3/t9-,10-,11+,12+,13-,14-/m1/s1
PDB

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4.85n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314757
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCCCF)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C13H20F4N2O4S/c1-19(2)12-18-6-7(20)8(21)9(23-11(6)24-12)10(13(15,16)17)22-5-3-4-14/h6-11,20-21H,3-5H2,1-2H3/t6-,7-,8+,9+,10-,11-/m1/s1
PDB

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4.88n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314721
PNG
((3aR,5S,6S,7R,7aR)-2-(methylamino)-5-((S)-2,2,2-tr...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@@H](Oc3ccccc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C15H17F3N2O4S/c1-19-14-20-8-9(21)10(22)11(24-13(8)25-14)12(15(16,17)18)23-7-5-3-2-4-6-7/h2-6,8-13,21-22H,1H3,(H,19,20)/t8-,9-,10+,11+,12-,13-/m1/s1
PDB

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4.98n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314743
PNG
((3aR,5S,6S,7R,7aR)-2-(methylamino)-5-((R)-2,2,2-tr...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@@H](Oc3ccc(cc3)[N+]([O-])=O)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C15H16F3N3O6S/c1-19-14-20-8-9(22)10(23)11(27-13(8)28-14)12(15(16,17)18)26-7-4-2-6(3-5-7)21(24)25/h2-5,8-13,22-23H,1H3,(H,19,20)/t8-,9-,10+,11+,12-,13-/m1/s1
PDB

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5.06n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314807
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((S)-1-(4-...)
Show SMILES COc1ccc(CO[C@@H](C)[C@H]2O[C@@H]3SC(=N[C@@H]3[C@@H](O)[C@@H]2O)N(C)C)cc1
Show InChI InChI=1S/C18H26N2O5S/c1-10(24-9-11-5-7-12(23-4)8-6-11)16-15(22)14(21)13-17(25-16)26-18(19-13)20(2)3/h5-8,10,13-17,21-22H,9H2,1-4H3/t10-,13+,14+,15-,16+,17+/m0/s1
PDB

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6.73n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314755
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](OCCF)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C12H18F4N2O4S/c1-18(2)11-17-5-6(19)7(20)8(22-10(5)23-11)9(12(14,15)16)21-4-3-13/h5-10,19-20H,3-4H2,1-2H3/t5-,6-,7+,8+,9-,10-/m1/s1
PDB

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8.83n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314774
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES C[C@@H](O[C@H]([C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C18H23F3N2O4S/c1-9(10-7-5-4-6-8-10)26-15(18(19,20)21)14-13(25)12(24)11-16(27-14)28-17(22-11)23(2)3/h4-9,11-16,24-25H,1-3H3/t9-,11-,12-,13+,14+,15-,16-/m1/s1
PDB

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10.3n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314705
PNG
((3aR,5S,6S,7R,7aR)-2-(dimethylamino)-5-((S)-2,2,2-...)
Show SMILES CO[C@@H]([C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C)C(F)(F)F
Show InChI InChI=1S/C11H17F3N2O4S/c1-16(2)10-15-4-5(17)6(18)7(20-9(4)21-10)8(19-3)11(12,13)14/h4-9,17-18H,1-3H3/t4-,5-,6+,7+,8+,9-/m1/s1
PDB

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10.8n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314806
PNG
((3aR,5S,6S,7R,7aR)-5-((S)-1- (benzyloxy)ethyl)-2- ...)
Show SMILES C[C@H](OCc1ccccc1)[C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C
Show InChI InChI=1S/C17H24N2O4S/c1-10(22-9-11-7-5-4-6-8-11)15-14(21)13(20)12-16(23-15)24-17(18-12)19(2)3/h4-8,10,12-16,20-21H,9H2,1-3H3/t10-,12+,13+,14-,15+,16+/m0/s1
PDB

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12.2n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314802
PNG
((3aR,5S,6S,7R,7aR)-2- (ethylamino)-5-((R)-2,2,2- t...)
Show SMILES CCNC1=N[C@H]2[C@H](O[C@H]([C@@H](OCc3ccc(OC)cc3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C18H23F3N2O5S/c1-3-22-17-23-11-12(24)13(25)14(28-16(11)29-17)15(18(19,20)21)27-8-9-4-6-10(26-2)7-5-9/h4-7,11-16,24-25H,3,8H2,1-2H3,(H,22,23)/t11-,12-,13+,14+,15-,16-/m1/s1
PDB

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12.5n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314773
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES C[C@H](O[C@H]([C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C)C(F)(F)F)c1ccccc1
Show InChI InChI=1S/C18H23F3N2O4S/c1-9(10-7-5-4-6-8-10)26-15(18(19,20)21)14-13(25)12(24)11-16(27-14)28-17(22-11)23(2)3/h4-9,11-16,24-25H,1-3H3/t9-,11+,12+,13-,14-,15+,16+/m0/s1
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20.4n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314749
PNG
((3aR,5R,6S,7R,7aR)-2-(dimethylamino)-5-((R)-2,2,2-...)
Show SMILES CN[C@H]([C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C)C(F)(F)F
Show InChI InChI=1S/C11H18F3N3O3S/c1-15-8(11(12,13)14)7-6(19)5(18)4-9(20-7)21-10(16-4)17(2)3/h4-9,15,18-19H,1-3H3/t4-,5-,6+,7+,8-,9-/m1/s1
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41.9n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314805
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((R)-2,2,2...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@H]([C@@H](Oc3ccccn3)C(F)(F)F)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C15H18F3N3O4S/c1-21(2)14-20-8-9(22)10(23)11(25-13(8)26-14)12(15(16,17)18)24-7-5-3-4-6-19-7/h3-6,8-13,22-23H,1-2H3/t8-,9-,10+,11+,12-,13-/m1/s1
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43.6n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314746
PNG
((3aR,5R,6S,7R,7aR)-5-((R)-1-(cyclopentylamino)ethy...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@H](C)NC3CCCC3)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C14H25N3O3S/c1-7(16-8-5-3-4-6-8)12-11(19)10(18)9-13(20-12)21-14(15-2)17-9/h7-13,16,18-19H,3-6H2,1-2H3,(H,15,17)/t7-,9+,10+,11-,12+,13+/m0/s1
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100n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314808
PNG
((3aR,5R,6S,7R,7aR)-5-(1- (cyclopropylamino)ethyl)-...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H](C(C)NC3CC3)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C12H21N3O3S/c1-5(14-6-3-4-6)10-9(17)8(16)7-11(18-10)19-12(13-2)15-7/h5-11,14,16-17H,3-4H2,1-2H3,(H,13,15)/t5?,7-,8-,9+,10-,11-/m1/s1
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102n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314746
PNG
((3aR,5R,6S,7R,7aR)-5-((R)-1-(cyclopentylamino)ethy...)
Show SMILES CNC1=N[C@H]2[C@H](O[C@H]([C@H](C)NC3CCCC3)[C@@H](O)[C@@H]2O)S1
Show InChI InChI=1S/C14H25N3O3S/c1-7(16-8-5-3-4-6-8)12-11(19)10(18)9-13(20-12)21-14(15-2)17-9/h7-13,16,18-19H,3-6H2,1-2H3,(H,15,17)/t7-,9+,10+,11-,12+,13+/m0/s1
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222n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314790
PNG
((3aR,5S,6S,7R,7aR)-5-((R)-2- (benzyloxy)-1,1,1-tri...)
Show SMILES CN(C)C1=N[C@H]2[C@H](O[C@@H]([C@@H](O)[C@@H]2O)[C@@](CCc2ccccc2)(OCc2ccccc2)C(F)(F)F)S1
Show InChI InChI=1S/C25H29F3N2O4S/c1-30(2)23-29-18-19(31)20(32)21(34-22(18)35-23)24(25(26,27)28,14-13-16-9-5-3-6-10-16)33-15-17-11-7-4-8-12-17/h3-12,18-22,31-32H,13-15H2,1-2H3/t18-,19-,20+,21+,22-,24-/m1/s1
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726n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
N-acetyl-beta-D-glucosaminidase (O-GlcNAcase)


(Homo sapiens (Human))
BDBM314789
PNG
((3aR,5S,6S,7R,7aR)-2- (dimethylamino)-5-((S)-1,1,1...)
Show SMILES CO[C@@](C)([C@H]1O[C@@H]2SC(=N[C@@H]2[C@@H](O)[C@@H]1O)N(C)C)C(F)(F)F
Show InChI InChI=1S/C12H19F3N2O4S/c1-11(20-4,12(13,14)15)8-7(19)6(18)5-9(21-8)22-10(16-5)17(2)3/h5-9,18-19H,1-4H3/t5-,6-,7+,8+,9-,11+/m1/s1
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2.25E+3n/an/an/an/an/an/an/an/a



ALECTOS THERAPEUTICS, INC.; MERCK SHARP & DOHME CORP.

US Patent


Assay Description
Enzymatic reactions were carried out in a reaction containing 50 mM NaH2PO4, 100 mM NaCl and 0.1% BSA (pH 7.0) using 2 mM 4-Methylumbelliferyl N-acet...


US Patent US9611275 (2017)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%