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Patent code US9359293

Compile Data Set for Download or QSAR
Found 24 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
NAD-dependent deacetylase sirtuin 2


(Homo sapiens (human))
BDBM234208
PNG
(US9359293, TM)
Show SMILES CCCCCCCCCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C33H49N3O3S/c1-2-3-4-5-6-7-8-9-10-11-18-26-31(40)34-27-20-19-25-30(32(37)35-28-21-14-12-15-22-28)36-33(38)39-29-23-16-13-17-24-29/h12-17,21-24,30H,2-11,18-20,25-27H2,1H3,(H,34,40)(H,35,37)(H,36,38)
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UniChem
US Patent
n/an/a 50n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent deacetylase sirtuin 2


(Homo sapiens (human))
BDBM234207
PNG
(US9359293, TH)
Show SMILES CCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C26H35N3O3S/c1-2-3-4-11-19-24(33)27-20-13-12-18-23(25(30)28-21-14-7-5-8-15-21)29-26(31)32-22-16-9-6-10-17-22/h5-10,14-17,23H,2-4,11-13,18-20H2,1H3,(H,27,33)(H,28,30)(H,29,31)
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UniChem
US Patent
n/an/a 120n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-Dependent Deacetylase Sirtuin-1


(Homo sapiens (human))
BDBM234207
PNG
(US9359293, TH)
Show SMILES CCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C26H35N3O3S/c1-2-3-4-11-19-24(33)27-20-13-12-18-23(25(30)28-21-14-7-5-8-15-21)29-26(31)32-22-16-9-6-10-17-22/h5-10,14-17,23H,2-4,11-13,18-20H2,1H3,(H,27,33)(H,28,30)(H,29,31)
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CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-Dependent Deacetylase Sirtuin-1


(Homo sapiens (human))
BDBM234206
PNG
(US9359293, TB)
Show SMILES CCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C23H29N3O3S/c1-2-11-21(30)24-17-10-9-16-20(22(27)25-18-12-5-3-6-13-18)26-23(28)29-19-14-7-4-8-15-19/h3-8,12-15,20H,2,9-11,16-17H2,1H3,(H,24,30)(H,25,27)(H,26,28)
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US Patent
n/an/a 2.40E+3n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent deacetylase sirtuin 2


(Homo sapiens (human))
BDBM234206
PNG
(US9359293, TB)
Show SMILES CCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C23H29N3O3S/c1-2-11-21(30)24-17-10-9-16-20(22(27)25-18-12-5-3-6-13-18)26-23(28)29-19-14-7-4-8-15-19/h3-8,12-15,20H,2,9-11,16-17H2,1H3,(H,24,30)(H,25,27)(H,26,28)
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UniChem
US Patent
n/an/a 3.00E+3n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-Dependent Deacetylase Sirtuin-1


(Homo sapiens (human))
BDBM234205
PNG
(US9359293, TA)
Show SMILES CC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C21H25N3O3S/c1-16(28)22-15-9-8-14-19(20(25)23-17-10-4-2-5-11-17)24-21(26)27-18-12-6-3-7-13-18/h2-7,10-13,19H,8-9,14-15H2,1H3,(H,22,28)(H,23,25)(H,24,26)
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US Patent
n/an/a 3.00E+4n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-3 (SIRT3)


(Homo sapiens (Human))
BDBM234207
PNG
(US9359293, TH)
Show SMILES CCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C26H35N3O3S/c1-2-3-4-11-19-24(33)27-20-13-12-18-23(25(30)28-21-14-7-5-8-15-21)29-26(31)32-22-16-9-6-10-17-22/h5-10,14-17,23H,2-4,11-13,18-20H2,1H3,(H,27,33)(H,28,30)(H,29,31)
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UniChem
US Patent
n/an/a 1.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent deacetylase sirtuin 2


(Homo sapiens (human))
BDBM234205
PNG
(US9359293, TA)
Show SMILES CC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C21H25N3O3S/c1-16(28)22-15-9-8-14-19(20(25)23-17-10-4-2-5-11-17)24-21(26)27-18-12-6-3-7-13-18/h2-7,10-13,19H,8-9,14-15H2,1H3,(H,22,28)(H,23,25)(H,24,26)
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US Patent
n/an/a 1.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-3 (SIRT3)


(Homo sapiens (Human))
BDBM234206
PNG
(US9359293, TB)
Show SMILES CCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C23H29N3O3S/c1-2-11-21(30)24-17-10-9-16-20(22(27)25-18-12-5-3-6-13-18)26-23(28)29-19-14-7-4-8-15-19/h3-8,12-15,20H,2,9-11,16-17H2,1H3,(H,24,30)(H,25,27)(H,26,28)
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PC sid
UniChem
US Patent
n/an/a 1.13E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-3 (SIRT3)


(Homo sapiens (Human))
BDBM234208
PNG
(US9359293, TM)
Show SMILES CCCCCCCCCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C33H49N3O3S/c1-2-3-4-5-6-7-8-9-10-11-18-26-31(40)34-27-20-19-25-30(32(37)35-28-21-14-12-15-22-28)36-33(38)39-29-23-16-13-17-24-29/h12-17,21-24,30H,2-11,18-20,25-27H2,1H3,(H,34,40)(H,35,37)(H,36,38)
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UniChem
US Patent
n/an/a 1.24E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-7 (SIRT7)


(Homo sapiens (Human))
BDBM234208
PNG
(US9359293, TM)
Show SMILES CCCCCCCCCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C33H49N3O3S/c1-2-3-4-5-6-7-8-9-10-11-18-26-31(40)34-27-20-19-25-30(32(37)35-28-21-14-12-15-22-28)36-33(38)39-29-23-16-13-17-24-29/h12-17,21-24,30H,2-11,18-20,25-27H2,1H3,(H,34,40)(H,35,37)(H,36,38)
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US Patent
n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
Sirtuin-6 (SIRT6)


(Homo sapiens (Human))
BDBM234207
PNG
(US9359293, TH)
Show SMILES CCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C26H35N3O3S/c1-2-3-4-11-19-24(33)27-20-13-12-18-23(25(30)28-21-14-7-5-8-15-21)29-26(31)32-22-16-9-6-10-17-22/h5-10,14-17,23H,2-4,11-13,18-20H2,1H3,(H,27,33)(H,28,30)(H,29,31)
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UniChem
US Patent
n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-5 (SIRT5)


(Homo sapiens (Human))
BDBM234206
PNG
(US9359293, TB)
Show SMILES CCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C23H29N3O3S/c1-2-11-21(30)24-17-10-9-16-20(22(27)25-18-12-5-3-6-13-18)26-23(28)29-19-14-7-4-8-15-19/h3-8,12-15,20H,2,9-11,16-17H2,1H3,(H,24,30)(H,25,27)(H,26,28)
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US Patent
n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
Sirtuin-6 (SIRT6)


(Homo sapiens (Human))
BDBM234208
PNG
(US9359293, TM)
Show SMILES CCCCCCCCCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C33H49N3O3S/c1-2-3-4-5-6-7-8-9-10-11-18-26-31(40)34-27-20-19-25-30(32(37)35-28-21-14-12-15-22-28)36-33(38)39-29-23-16-13-17-24-29/h12-17,21-24,30H,2-11,18-20,25-27H2,1H3,(H,34,40)(H,35,37)(H,36,38)
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US Patent
n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-Dependent Deacetylase Sirtuin-1


(Homo sapiens (human))
BDBM234208
PNG
(US9359293, TM)
Show SMILES CCCCCCCCCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C33H49N3O3S/c1-2-3-4-5-6-7-8-9-10-11-18-26-31(40)34-27-20-19-25-30(32(37)35-28-21-14-12-15-22-28)36-33(38)39-29-23-16-13-17-24-29/h12-17,21-24,30H,2-11,18-20,25-27H2,1H3,(H,34,40)(H,35,37)(H,36,38)
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CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-5 (SIRT5)


(Homo sapiens (Human))
BDBM234207
PNG
(US9359293, TH)
Show SMILES CCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C26H35N3O3S/c1-2-3-4-11-19-24(33)27-20-13-12-18-23(25(30)28-21-14-7-5-8-15-21)29-26(31)32-22-16-9-6-10-17-22/h5-10,14-17,23H,2-4,11-13,18-20H2,1H3,(H,27,33)(H,28,30)(H,29,31)
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n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
Sirtuin-6 (SIRT6)


(Homo sapiens (Human))
BDBM234206
PNG
(US9359293, TB)
Show SMILES CCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C23H29N3O3S/c1-2-11-21(30)24-17-10-9-16-20(22(27)25-18-12-5-3-6-13-18)26-23(28)29-19-14-7-4-8-15-19/h3-8,12-15,20H,2,9-11,16-17H2,1H3,(H,24,30)(H,25,27)(H,26,28)
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CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-5 (SIRT5)


(Homo sapiens (Human))
BDBM234208
PNG
(US9359293, TM)
Show SMILES CCCCCCCCCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C33H49N3O3S/c1-2-3-4-5-6-7-8-9-10-11-18-26-31(40)34-27-20-19-25-30(32(37)35-28-21-14-12-15-22-28)36-33(38)39-29-23-16-13-17-24-29/h12-17,21-24,30H,2-11,18-20,25-27H2,1H3,(H,34,40)(H,35,37)(H,36,38)
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CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-7 (SIRT7)


(Homo sapiens (Human))
BDBM234207
PNG
(US9359293, TH)
Show SMILES CCCCCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C26H35N3O3S/c1-2-3-4-11-19-24(33)27-20-13-12-18-23(25(30)28-21-14-7-5-8-15-21)29-26(31)32-22-16-9-6-10-17-22/h5-10,14-17,23H,2-4,11-13,18-20H2,1H3,(H,27,33)(H,28,30)(H,29,31)
PDB

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UniChem
US Patent
n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-7 (SIRT7)


(Homo sapiens (Human))
BDBM234205
PNG
(US9359293, TA)
Show SMILES CC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C21H25N3O3S/c1-16(28)22-15-9-8-14-19(20(25)23-17-10-4-2-5-11-17)24-21(26)27-18-12-6-3-7-13-18/h2-7,10-13,19H,8-9,14-15H2,1H3,(H,22,28)(H,23,25)(H,24,26)
PDB

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n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-5 (SIRT5)


(Homo sapiens (Human))
BDBM234205
PNG
(US9359293, TA)
Show SMILES CC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C21H25N3O3S/c1-16(28)22-15-9-8-14-19(20(25)23-17-10-4-2-5-11-17)24-21(26)27-18-12-6-3-7-13-18/h2-7,10-13,19H,8-9,14-15H2,1H3,(H,22,28)(H,23,25)(H,24,26)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-3 (SIRT3)


(Homo sapiens (Human))
BDBM234205
PNG
(US9359293, TA)
Show SMILES CC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C21H25N3O3S/c1-16(28)22-15-9-8-14-19(20(25)23-17-10-4-2-5-11-17)24-21(26)27-18-12-6-3-7-13-18/h2-7,10-13,19H,8-9,14-15H2,1H3,(H,22,28)(H,23,25)(H,24,26)
PDB

UniProtKB/SwissProt

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PC cid
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UniChem
US Patent
n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-7 (SIRT7)


(Homo sapiens (Human))
BDBM234206
PNG
(US9359293, TB)
Show SMILES CCCC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C23H29N3O3S/c1-2-11-21(30)24-17-10-9-16-20(22(27)25-18-12-5-3-6-13-18)26-23(28)29-19-14-7-4-8-15-19/h3-8,12-15,20H,2,9-11,16-17H2,1H3,(H,24,30)(H,25,27)(H,26,28)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


Citation and Details
More data for this
Ligand-Target Pair
Sirtuin-6 (SIRT6)


(Homo sapiens (Human))
BDBM234205
PNG
(US9359293, TA)
Show SMILES CC(=S)NCCCCC(NC(=O)Oc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C21H25N3O3S/c1-16(28)22-15-9-8-14-19(20(25)23-17-10-4-2-5-11-17)24-21(26)27-18-12-6-3-7-13-18/h2-7,10-13,19H,8-9,14-15H2,1H3,(H,22,28)(H,23,25)(H,24,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>2.05E+5n/an/an/an/an/an/a



CORNELL UNIVERSITY

US Patent


Assay Description
Different concentrations of TA, TB, TH, or TM were pre-incubated with 1 μM of the sirtuin and 1 mM NAD in 20 mM Tris-HCl buffer (pH 8.0) with 1 ...


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