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Compile Data Set for Download or QSAR

Found 853 hits with Last Name = 'giri' and Initial = 'ag'   
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
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM613669
PNG
(US11731972, Compound 11)
Show SMILES CC(N1CCC2(CC1)NC(=O)N(Cc1ccc(cc1)S(C)(=O)=O)C2=O)c1ccc2CCOc2c1
PDB

KEGG

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TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q2BP06X6
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM613670
PNG
(US11731972, Compound 12)
Show SMILES CC(N1CCC2(CC1)NC(=O)N(C2=O)c1ccc(cc1)C#N)c1ccc2CCOc2c1
PDB

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Citation and Details

BindingDB Entry DOI: 10.7270/Q2BP06X6
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM613711
PNG
(US11731972, Compound 59)
Show SMILES CC(N1CCC2(CN(C(=O)N2)c2cccnn2)CC1)c1ccc2scnc2c1
PDB

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Citation and Details

BindingDB Entry DOI: 10.7270/Q2BP06X6
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM613731
PNG
(US11731972, Compound IA6)
Show SMILES CSc1cnc(nc1)N1CC2(CCN(Cc3cnc(NC(C)=O)s3)CC2)NC1=O
PDB

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Citation and Details

BindingDB Entry DOI: 10.7270/Q2BP06X6
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM613729
PNG
(US11731972, Compound IA4)
Show SMILES CC(=O)Nc1ncc(CN2CCC3(CC2)NC(=O)N(Cc2cc(C)nc(C)c2)C3=O)s1
PDB

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Citation and Details

BindingDB Entry DOI: 10.7270/Q2BP06X6
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM613730
PNG
(US11731972, Compound IA5)
Show SMILES CC(=O)Nc1ncc(CN2CCC3(CC2)NC(=O)N(Cc2ccnc(C)c2)C3=O)s1
PDB

KEGG

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Citation and Details

BindingDB Entry DOI: 10.7270/Q2BP06X6
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM613712
PNG
(US11731972, Compound 60)
Show SMILES CC(N1CCC2(CC1)NC(=O)N(C2=O)c1cc(C)nc(C)c1)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details

BindingDB Entry DOI: 10.7270/Q2BP06X6
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628173
PNG
(US11795165, Compound 31)
Show SMILES COc1ccc2CCN(CCc2n1)C(C)c1ccc2scnc2c1
PDB

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628175
PNG
(US11795165, Compound 33)
Show SMILES CC(N1CCc2ccc(O)cc2CC1)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628176
PNG
(US11795165, Compound 34)
Show SMILES COc1ccc2CCN(CCc2c1)C(C)c1cnc2CCOc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628177
PNG
(US11795165, Compound 37)
Show SMILES CC(N1CCc2ccc(cc2CC1)S(C)(=N)=O)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628181
PNG
(US11795165, Compound 43)
Show SMILES CC(N1CCc2ccc(NC(C)=O)cc2CC1)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628182
PNG
(US11795165, Compound 51)
Show SMILES CC(N1CCc2cc(cnc2CC1)S(C)(=O)=O)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628183
PNG
(US11795165, Compound 52)
Show SMILES CC(N1CCc2cc(cnc2CC1)S(C)(=N)=O)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628184
PNG
(US11795165, Compound 60)
Show SMILES CC(N1CCc2ccc(Oc3ccnc(C)c3)cc2CC1)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628185
PNG
(US11795165, Compound 62)
Show SMILES CC(N1CCc2ccc(Oc3cc(C)nc(C)n3)cc2CC1)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628186
PNG
(US11795165, Compound 92)
Show SMILES CC(N1CCc2cc(NC(C)=O)cnc2CC1)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628189
PNG
(US11795165, Compound 108)
Show SMILES CC(N1CCc2cnc(N)nc2CC1)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628190
PNG
(US11795165, Compound 109)
Show SMILES CC(N1CCc2ccc(cc2CC1)-c1cnn(C)c1)c1ccc2scnc2c1
PDB

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628192
PNG
(US11795165, Compound 111)
Show SMILES CSc1ccc2CCN(CCc2c1)C(C)c1ccc2scnc2c1
PDB

KEGG

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628194
PNG
(US11795165, Compound 113 | US11795165, Compound 11...)
Show SMILES CC(N1CCc2ccc(cc2CC1)S(C)(=N)=O)c1ccc2scnc2c1 |w:1.0,8.14,13.15|
PDB

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628194
PNG
(US11795165, Compound 113 | US11795165, Compound 11...)
Show SMILES CC(N1CCc2ccc(cc2CC1)S(C)(=N)=O)c1ccc2scnc2c1 |w:1.0,8.14,13.15|
PDB

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628198
PNG
(US11795165, Compound 117)
Show SMILES CC(N1CCc2cc(N)cnc2CC1)c1ccc2scnc2c1
PDB

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628199
PNG
(US11795165, Compound 118 | US11795165, Compound 11...)
Show SMILES CSc1ccc2CCN(CCc2c1)C(C)c1ccc2scnc2c1 |w:13.15|
PDB

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM628201
PNG
(US11795165, Compound 120)
Show SMILES CC(N1CCc2cc(NS(=O)(=O)C3CC3)cnc2CC1)c1ccc2scnc2c1
PDB

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Citation and Details
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430400
PNG
(US10556902, No 10 | US11612599, Compound 10)
Show SMILES CC(N1CCN(CC1)c1nc2CCN(Cc2s1)C(C)=O)c1ccc2CCOc2c1
Show InChI InChI=1S/C22H28N4O2S/c1-15(18-4-3-17-6-12-28-20(17)13-18)24-8-10-25(11-9-24)22-23-19-5-7-26(16(2)27)14-21(19)29-22/h3-4,13,15H,5-12,14H2,1-2H3
PDB

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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430402
PNG
(US10556902, No 12 | US11612599, Compound 12)
Show SMILES CC(N1CCN(CC1)c1nc2CCNC(=O)c2s1)c1ccc2CCOc2c1
Show InChI InChI=1S/C20H24N4O2S/c1-13(15-3-2-14-5-11-26-17(14)12-15)23-7-9-24(10-8-23)20-22-16-4-6-21-19(25)18(16)27-20/h2-3,12-13H,4-11H2,1H3,(H,21,25)
PDB

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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430403
PNG
(US10556902, No 13 | US11612599, Compound 13)
Show SMILES CC(N1CCN(CC1)c1nc2CCN(C)C(=O)c2s1)c1ccc2CCOc2c1
Show InChI InChI=1S/C21H26N4O2S/c1-14(16-4-3-15-6-12-27-18(15)13-16)24-8-10-25(11-9-24)21-22-17-5-7-23(2)20(26)19(17)28-21/h3-4,13-14H,5-12H2,1-2H3
PDB

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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430405
PNG
(US10556902, No 15 | US11612599, Compound 15)
Show SMILES CC(N1CCN(CC1)c1nc2CCNCc2s1)c1ccc2CCOc2c1
Show InChI InChI=1S/C20H26N4OS/c1-14(16-3-2-15-5-11-25-18(15)12-16)23-7-9-24(10-8-23)20-22-17-4-6-21-13-19(17)26-20/h2-3,12,14,21H,4-11,13H2,1H3
PDB

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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430406
PNG
(US10556902, No 16 | US11612599, Compound 16)
Show SMILES CC(N1CCN(CC1)c1nc2CCN(C)Cc2s1)c1ccc2CCOc2c1
Show InChI InChI=1S/C21H28N4OS/c1-15(17-4-3-16-6-12-26-19(16)13-17)24-8-10-25(11-9-24)21-22-18-5-7-23(2)14-20(18)27-21/h3-4,13,15H,5-12,14H2,1-2H3
PDB

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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM598004
PNG
(US11612599, Compound 17)
Show SMILES C[C@H](N1CCN(CC1)c1nc2CCNCc2s1)c1ccc2CCOc2c1 |r|
PDB

KEGG

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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430413
PNG
(US10556902, No 23 | US11612599, Compound 23)
Show SMILES CC(N1CCC(CC1)c1nnc(C)o1)c1ccc2CCOc2c1
Show InChI InChI=1S/C18H23N3O2/c1-12(16-4-3-14-7-10-22-17(14)11-16)21-8-5-15(6-9-21)18-20-19-13(2)23-18/h3-4,11-12,15H,5-10H2,1-2H3
PDB

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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430425
PNG
(US10556902, No 35 | US11612599, Compound 35)
Show SMILES CC(O)c1ccc(nn1)N1CCN(CC1)C(C)c1ccc2CCOc2c1
Show InChI InChI=1S/C20H26N4O2/c1-14(17-4-3-16-7-12-26-19(16)13-17)23-8-10-24(11-9-23)20-6-5-18(15(2)25)21-22-20/h3-6,13-15,25H,7-12H2,1-2H3
PDB

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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430430
PNG
(US10556902, No 40 | US11612599, Compound 40)
Show SMILES CC(N1CCN(CC1)c1ccc(nn1)C(F)(F)F)c1ccc2CCOc2c1
Show InChI InChI=1S/C19H21F3N4O/c1-13(15-3-2-14-6-11-27-16(14)12-15)25-7-9-26(10-8-25)18-5-4-17(23-24-18)19(20,21)22/h2-5,12-13H,6-11H2,1H3
PDB

KEGG

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n/an/a<50n/an/an/an/an/an/a


TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430435
PNG
(US10556902, No 45 | US11612599, Compound 45)
Show SMILES CC(N1CCN(CC1)c1ccc(nn1)S(C)(=O)=O)c1ccc2CCOc2c1
Show InChI InChI=1S/C19H24N4O3S/c1-14(16-4-3-15-7-12-26-17(15)13-16)22-8-10-23(11-9-22)18-5-6-19(21-20-18)27(2,24)25/h3-6,13-14H,7-12H2,1-2H3
PDB

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n/an/a<50n/an/an/an/an/an/a


TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430437
PNG
(US10556902, No 47 | US11612599, Compound 47)
Show SMILES CC(O)c1ccc(nc1)N1CCN(CC1)C(C)c1ccc2CCOc2c1
Show InChI InChI=1S/C21H27N3O2/c1-15(18-4-3-17-7-12-26-20(17)13-18)23-8-10-24(11-9-23)21-6-5-19(14-22-21)16(2)25/h3-6,13-16,25H,7-12H2,1-2H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430438
PNG
(US10556902, No 48 | US11612599, Compound 48)
Show SMILES CC(N1CCN(CC1)c1ccc(cn1)C(C)(C)O)c1ccc2CCOc2c1
Show InChI InChI=1S/C22H29N3O2/c1-16(18-5-4-17-8-13-27-20(17)14-18)24-9-11-25(12-10-24)21-7-6-19(15-23-21)22(2,3)26/h4-7,14-16,26H,8-13H2,1-3H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430439
PNG
(US10556902, No 49 | US11612599, Compound 49)
Show SMILES CC(C)C(O)c1ccc(nc1)N1CCN(CC1)C(C)c1ccc2CCOc2c1
Show InChI InChI=1S/C23H31N3O2/c1-16(2)23(27)20-6-7-22(24-15-20)26-11-9-25(10-12-26)17(3)19-5-4-18-8-13-28-21(18)14-19/h4-7,14-17,23,27H,8-13H2,1-3H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430440
PNG
(US10556902, No 50 | US11612599, Compound 50)
Show SMILES CC(N1CCN(CC1)c1ccc(cn1)C(O)C(F)(F)F)c1ccc2CCOc2c1
Show InChI InChI=1S/C21H24F3N3O2/c1-14(16-3-2-15-6-11-29-18(15)12-16)26-7-9-27(10-8-26)19-5-4-17(13-25-19)20(28)21(22,23)24/h2-5,12-14,20,28H,6-11H2,1H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430452
PNG
(US10556902, No 62 | US11612599, Compound 62)
Show SMILES COC(=O)c1ccc(nc1)N1CCN(CC1)C(C)c1ccc2CCOc2c1
Show InChI InChI=1S/C21H25N3O3/c1-15(17-4-3-16-7-12-27-19(16)13-17)23-8-10-24(11-9-23)20-6-5-18(14-22-20)21(25)26-2/h3-6,13-15H,7-12H2,1-2H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430453
PNG
(US10556902, No 63 | US11612599, Compound 63)
Show SMILES CC(N1CCN(CC1)c1ccc(cn1)C(=O)N(C)C)c1ccc2CCOc2c1
Show InChI InChI=1S/C22H28N4O2/c1-16(18-5-4-17-8-13-28-20(17)14-18)25-9-11-26(12-10-25)21-7-6-19(15-23-21)22(27)24(2)3/h4-7,14-16H,8-13H2,1-3H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430454
PNG
(US10556902, No 64 | US11612599, Compound 64)
Show SMILES CNC(=O)c1ccc(nc1)N1CCN(CC1)C(C)c1ccc2CCOc2c1
Show InChI InChI=1S/C21H26N4O2/c1-15(17-4-3-16-7-12-27-19(16)13-17)24-8-10-25(11-9-24)20-6-5-18(14-23-20)21(26)22-2/h3-6,13-15H,7-12H2,1-2H3,(H,22,26)
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430455
PNG
(US10556902, No 65 | US11612599, Compound 65)
Show SMILES CC(N1CCN(CC1)c1ccc(cn1)C(O)=O)c1ccc2CCOc2c1
Show InChI InChI=1S/C20H23N3O3/c1-14(16-3-2-15-6-11-26-18(15)12-16)22-7-9-23(10-8-22)19-5-4-17(13-21-19)20(24)25/h2-5,12-14H,6-11H2,1H3,(H,24,25)
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430461
PNG
(US10556902, No 71 | US11612599, Compound 71)
Show SMILES CC(N1CCN(CC1)c1ccc(cn1)S(C)(=O)=O)c1ccc2CCOc2c1
Show InChI InChI=1S/C20H25N3O3S/c1-15(17-4-3-16-7-12-26-19(16)13-17)22-8-10-23(11-9-22)20-6-5-18(14-21-20)27(2,24)25/h3-6,13-15H,7-12H2,1-2H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430463
PNG
(US10556902, No 73 | US11612599, Compound 73)
Show SMILES CC(N1CCN(CC1)c1ncc(CO)cn1)c1ccc2scnc2c1
Show InChI InChI=1S/C18H21N5OS/c1-13(15-2-3-17-16(8-15)21-12-25-17)22-4-6-23(7-5-22)18-19-9-14(11-24)10-20-18/h2-3,8-10,12-13,24H,4-7,11H2,1H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430464
PNG
(US10556902, No 74 | US11612599, Compound 74)
Show SMILES CC(N1CCN(CC1)c1ncc(cn1)C(C)(C)O)c1ccc2CCOc2c1
Show InChI InChI=1S/C21H28N4O2/c1-15(17-5-4-16-6-11-27-19(16)12-17)24-7-9-25(10-8-24)20-22-13-18(14-23-20)21(2,3)26/h4-5,12-15,26H,6-11H2,1-3H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430465
PNG
(US10556902, No 75 | US11612599, Compound 75)
Show SMILES CC(N1CCN(CC1)c1ncc(CO)cn1)c1ccc2CCOc2c1
Show InChI InChI=1S/C19H24N4O2/c1-14(17-3-2-16-4-9-25-18(16)10-17)22-5-7-23(8-6-22)19-20-11-15(13-24)12-21-19/h2-3,10-12,14,24H,4-9,13H2,1H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430466
PNG
(US10556902, No 76 | US11612599, Compound 76)
Show SMILES CC(N1CCN(CC1)c1ncc(cn1)C1(O)CC1)c1ccc2CCOc2c1
Show InChI InChI=1S/C21H26N4O2/c1-15(17-3-2-16-4-11-27-19(16)12-17)24-7-9-25(10-8-24)20-22-13-18(14-23-20)21(26)5-6-21/h2-3,12-15,26H,4-11H2,1H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430467
PNG
(US10556902, No 77 | US11612599, Compound 77)
Show SMILES CC(N1CCN(CC1)c1ncc(cn1)C(O)C(F)(F)F)c1ccc2CCOc2c1
Show InChI InChI=1S/C20H23F3N4O2/c1-13(15-3-2-14-4-9-29-17(14)10-15)26-5-7-27(8-6-26)19-24-11-16(12-25-19)18(28)20(21,22)23/h2-3,10-13,18,28H,4-9H2,1H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
Protein O-GlcNAcase


(Homo sapiens (Human))
BDBM430469
PNG
(US10556902, No 78 | US11612599, Compound 78)
Show SMILES CC(C)C(O)c1cnc(nc1)N1CCN(CC1)C(C)c1ccc2CCOc2c1
Show InChI InChI=1S/C22H30N4O2/c1-15(2)21(27)19-13-23-22(24-14-19)26-9-7-25(8-10-26)16(3)18-5-4-17-6-11-28-20(17)12-18/h4-5,12-16,21,27H,6-11H2,1-3H3
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TBA

Assay Description
5 μl of the appropriate concentration of a solution of inhibitor in McIlvaine's Buffer (pH 6.5) in 2% DMSO (for a dose response curve calcul...


Citation and Details

BindingDB Entry DOI: 10.7270/Q28D015W
More data for this
Ligand-Target Pair
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