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Patent code US9175357

Compile Data Set for Download or QSAR
Found 23 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
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190265
PNG
(US9175357, 5827)
Show SMILES CCCCc1ccc(cc1)C(=O)NC |w:12.13|
Show InChI InChI=1S/C12H17NO/c1-3-4-5-10-6-8-11(9-7-10)12(14)13-2/h6-9H,3-5H2,1-2H3,(H,13,14)
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US Patent
n/an/a 8.60E+3n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190264
PNG
(US9175357, 5826)
Show SMILES CCCc1ccc(cc1)C(=O)NC |w:11.12|
Show InChI InChI=1S/C11H15NO/c1-3-4-9-5-7-10(8-6-9)11(13)12-2/h5-8H,3-4H2,1-2H3,(H,12,13)
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US Patent
n/an/a 1.08E+4n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190261
PNG
(US9175357, 5788)
Show SMILES CCc1ccc(cc1)C(=O)NC |w:10.11|
Show InChI InChI=1S/C10H13NO/c1-3-8-4-6-9(7-5-8)10(12)11-2/h4-7H,3H2,1-2H3,(H,11,12)
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US Patent
n/an/a 1.65E+4n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190266
PNG
(US9175357, 5830)
Show SMILES CCCNc1ccc(cc1)C(=O)NC |w:12.13|
Show InChI InChI=1S/C11H16N2O/c1-3-8-13-10-6-4-9(5-7-10)11(14)12-2/h4-7,13H,3,8H2,1-2H3,(H,12,14)
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US Patent
n/an/a 1.65E+4n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190262
PNG
(US9175357, 5791)
Show SMILES CNC(=O)c1ccc(SC)cc1 |w:1.0|
Show InChI InChI=1S/C9H11NOS/c1-10-9(11)7-3-5-8(12-2)6-4-7/h3-6H,1-2H3,(H,10,11)
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US Patent
n/an/a 1.85E+4n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190259
PNG
(US9175357, 5785)
Show SMILES CCCOc1ccc(cc1)C(=O)NC |w:12.13|
Show InChI InChI=1S/C11H15NO2/c1-3-8-14-10-6-4-9(5-7-10)11(13)12-2/h4-7H,3,8H2,1-2H3,(H,12,13)
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US Patent
n/an/a 2.95E+4n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190263
PNG
(US9175357, 5792)
Show SMILES CNC(=O)c1ccc(NC)cc1 |w:1.0|
Show InChI InChI=1S/C9H12N2O/c1-10-8-5-3-7(4-6-8)9(12)11-2/h3-6,10H,1-2H3,(H,11,12)
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US Patent
n/an/a 3.12E+4n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190260
PNG
(US9175357, 5786)
Show SMILES CCOc1ccc(cc1)C(=O)NC |w:11.12|
Show InChI InChI=1S/C10H13NO2/c1-3-13-9-6-4-8(5-7-9)10(12)11-2/h4-7H,3H2,1-2H3,(H,11,12)
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US Patent
n/an/a 6.47E+4n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190258
PNG
(US9175357, 5756)
Show SMILES CNC(=O)c1ccc(OC)c2ccccc12 |w:1.0|
Show InChI InChI=1S/C13H13NO2/c1-14-13(15)11-7-8-12(16-2)10-6-4-3-5-9(10)11/h3-8H,1-2H3,(H,14,15)
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US Patent
n/an/a 9.90E+4n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190256
PNG
(US9175357, 5753)
Show SMILES CNC(=O)c1cccc2ccccc12 |w:1.0|
Show InChI InChI=1S/C12H11NO/c1-13-12(14)11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)
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US Patent
n/an/a 1.04E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190257
PNG
(US9175357, 5754)
Show SMILES CNC(=O)c1ccc(OC)cc1 |w:1.0|
Show InChI InChI=1S/C9H11NO2/c1-10-9(11)7-3-5-8(12-2)6-4-7/h3-6H,1-2H3,(H,10,11)
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US Patent
n/an/a 1.25E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190253
PNG
(US9175357, 5603)
Show SMILES CNC(=O)Cn1cc(ncc1=O)-c1ccc(C)cc1 |w:1.0|
Show InChI InChI=1S/C14H15N3O2/c1-10-3-5-11(6-4-10)12-8-17(9-13(18)15-2)14(19)7-16-12/h3-8H,9H2,1-2H3,(H,15,18)
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n/an/a 2.50E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190254
PNG
(US9175357, 5604)
Show SMILES CNC(=O)c1cc(OC)c2OCCOc2c1 |w:1.0|
Show InChI InChI=1S/C11H13NO4/c1-12-11(13)7-5-8(14-2)10-9(6-7)15-3-4-16-10/h5-6H,3-4H2,1-2H3,(H,12,13)
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US Patent
n/an/a 3.00E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190249
PNG
(US9175357, 5598)
Show SMILES CNC(=O)c1ccc(cc1)-c1noc(C)n1 |w:1.0|
Show InChI InChI=1S/C11H11N3O2/c1-7-13-10(14-16-7)8-3-5-9(6-4-8)11(15)12-2/h3-6H,1-2H3,(H,12,15)
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US Patent
n/an/a 3.20E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190246
PNG
(US9175357, 5594)
Show SMILES CNC(=O)CN1C(=O)COc2ccc(C)cc12 |w:1.0|
Show InChI InChI=1S/C12H14N2O3/c1-8-3-4-10-9(5-8)14(6-11(15)13-2)12(16)7-17-10/h3-5H,6-7H2,1-2H3,(H,13,15)
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US Patent
n/an/a 3.50E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190244
PNG
(US9175357, 5591)
Show SMILES CNC(=O)c1cn(c2ccccc12)S(=O)(=O)c1ccccc1 |w:1.0|
Show InChI InChI=1S/C16H14N2O3S/c1-17-16(19)14-11-18(15-10-6-5-9-13(14)15)22(20,21)12-7-3-2-4-8-12/h2-11H,1H3,(H,17,19)
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US Patent
n/an/a 3.75E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190245
PNG
(US9175357, 5593)
Show SMILES CNC(=O)c1cc(n[nH]1)-c1cccc(OC)c1 |w:1.0|
Show InChI InChI=1S/C12H13N3O2/c1-13-12(16)11-7-10(14-15-11)8-4-3-5-9(6-8)17-2/h3-7H,1-2H3,(H,13,16)(H,14,15)
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US Patent
n/an/a 3.80E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190252
PNG
(US9175357, 5601)
Show SMILES CNC(=O)c1ccc2ncccc2c1 |w:1.0|
Show InChI InChI=1S/C11H10N2O/c1-12-11(14)9-4-5-10-8(7-9)3-2-6-13-10/h2-7H,1H3,(H,12,14)
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US Patent
n/an/a 4.00E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190247
PNG
(US9175357, 5595)
Show SMILES CNC(=O)CSc1ncnc2sc(C)cc12 |w:1.0|
Show InChI InChI=1S/C10H11N3OS2/c1-6-3-7-9(15-4-8(14)11-2)12-5-13-10(7)16-6/h3,5H,4H2,1-2H3,(H,11,14)
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US Patent
n/an/a 4.75E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190248
PNG
(US9175357, 5597)
Show SMILES CNC(=O)c1cc(c(s1)C(F)(F)F)-c1ccccc1
Show InChI InChI=1S/C13H10F3NOS/c1-17-12(18)10-7-9(8-5-3-2-4-6-8)11(19-10)13(14,15)16/h2-7H,1H3,(H,17,18)
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US Patent
n/an/a 5.00E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190251
PNG
(US9175357, 5600)
Show SMILES CNC(=O)C1=CC(CCCN2CCOCC2)[N](=C1C)c1ccccc1 |w:1.0,c:17,t:4|
Show InChI InChI=1S/C20H28N3O2/c1-16-19(20(24)21-2)15-18(23(16)17-7-4-3-5-8-17)9-6-10-22-11-13-25-14-12-22/h3-5,7-8,15,18H,6,9-14H2,1-2H3,(H,21,24)
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US Patent
n/an/a 5.50E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190255
PNG
(US9175357, 5607)
Show SMILES CNC(=O)c1sc(c(c1N)-c1ccccc1)C(F)(F)F
Show InChI InChI=1S/C13H11F3N2OS/c1-18-12(19)10-9(17)8(7-5-3-2-4-6-7)11(20-10)13(14,15)16/h2-6H,17H2,1H3,(H,18,19)
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US Patent
n/an/a>6.00E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM190250
PNG
(US9175357, 5599)
Show SMILES CNC(=O)c1cc(-c2ccccc2)n(c1C)-c1ccccc1 |w:1.0|
Show InChI InChI=1S/C19H18N2O/c1-14-17(19(22)20-2)13-18(15-9-5-3-6-10-15)21(14)16-11-7-4-8-12-16/h3-13H,1-2H3,(H,20,22)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 6.00E+5n/an/an/an/a8.025



UNIVERSITY OF SOUTH CAROLINA

US Patent


Assay Description
The buffer composition was 50 mM Tris, 200 mM NaCl, 2.0 mM DTT, and 0.005% Tween 20 (pH 8.0). Fragment ligated inhibitors and comparison peptides to ...


US Patent US9175357 (2015)


BindingDB Entry DOI: 10.7270/Q2V40T14
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%