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20 similar compounds to monomer 120876

Compile data set for download or QSAR
Wt: 390.4
BDBM120869
Wt: 408.4
BDBM120870
Wt: 424.8
BDBM120871
Wt: 442.8
BDBM120872
Wt: 438.8
BDBM120874
Wt: 441.3
BDBM120875
Wt: 441.3
BDBM120877
Wt: 438.8
BDBM120878
Wt: 436.8
BDBM120879
Wt: 441.3
BDBM120880
Wt: 436.8
BDBM120882
Wt: 474.8
BDBM120884
Wt: 438.8
BDBM120885
Wt: 454.8
BDBM120886
Wt: 424.8
BDBM120890
Displayed 1 to 15 (of 20 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 120869,120870,120871,120872,120874,120875,120877,120878,120879,120880,120882,120884,120885,120886,120890   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120869
PNG
(US8716287, 2)
Show SMILES Fc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2)cc1
Show InChI InChI=1S/C21H19FN6O/c22-17-5-1-16(2-6-17)12-24-10-9-15-3-7-18(8-4-15)27-21(29)28-20-14-25-19(11-23)13-26-20/h1-8,13-14,24H,9-10,12H2,(H2,26,27,28,29)
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n/an/a 44n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120890
PNG
(US8716287, 23)
Show SMILES Fc1ccccc1CNCCc1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1Cl
Show InChI InChI=1S/C21H18ClFN6O/c22-18-9-16(28-21(30)29-20-13-26-17(10-24)12-27-20)6-5-14(18)7-8-25-11-15-3-1-2-4-19(15)23/h1-6,9,12-13,25H,7-8,11H2,(H2,27,28,29,30)
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n/an/a 11n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120871
PNG
(US8716287, 4)
Show SMILES Fc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1
Show InChI InChI=1S/C21H18ClFN6O/c22-19-9-17(28-21(30)29-20-13-26-18(10-24)12-27-20)6-3-15(19)7-8-25-11-14-1-4-16(23)5-2-14/h1-6,9,12-13,25H,7-8,11H2,(H2,27,28,29,30)
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n/an/a 15n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120872
PNG
(US8716287, 5)
Show SMILES Fc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c(F)c1
Show InChI InChI=1S/C21H17ClF2N6O/c22-18-8-16(29-21(31)30-20-12-27-17(9-25)11-28-20)4-2-13(18)5-6-26-10-14-1-3-15(23)7-19(14)24/h1-4,7-8,11-12,26H,5-6,10H2,(H2,28,29,30,31)
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n/an/a 38n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120874
PNG
(US8716287, 7)
Show SMILES Fc1ccc(CCNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1
Show InChI InChI=1S/C22H20ClFN6O/c23-20-11-18(29-22(31)30-21-14-27-19(12-25)13-28-21)6-3-16(20)8-10-26-9-7-15-1-4-17(24)5-2-15/h1-6,11,13-14,26H,7-10H2,(H2,28,29,30,31)
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n/an/a 16n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120875
PNG
(US8716287, 8)
Show SMILES Clc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1
Show InChI InChI=1S/C21H18Cl2N6O/c22-16-4-1-14(2-5-16)11-25-8-7-15-3-6-17(9-19(15)23)28-21(30)29-20-13-26-18(10-24)12-27-20/h1-6,9,12-13,25H,7-8,11H2,(H2,27,28,29,30)
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n/an/a 11n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120877
PNG
(US8716287, 10)
Show SMILES Clc1ccccc1CNCCc1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1Cl
Show InChI InChI=1S/C21H18Cl2N6O/c22-18-4-2-1-3-15(18)11-25-8-7-14-5-6-16(9-19(14)23)28-21(30)29-20-13-26-17(10-24)12-27-20/h1-6,9,12-13,25H,7-8,11H2,(H2,27,28,29,30)
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n/an/a 62n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120878
PNG
(US8716287, 11)
Show SMILES CN(CCc1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1Cl)Cc1ccc(F)cc1
Show InChI InChI=1S/C22H20ClFN6O/c1-30(14-15-2-5-17(24)6-3-15)9-8-16-4-7-18(10-20(16)23)28-22(31)29-21-13-26-19(11-25)12-27-21/h2-7,10,12-13H,8-9,14H2,1H3,(H2,27,28,29,31)
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n/an/a 146n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120879
PNG
(US8716287, 12)
Show SMILES COc1cccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c1
Show InChI InChI=1S/C22H21ClN6O2/c1-31-19-4-2-3-15(9-19)12-25-8-7-16-5-6-17(10-20(16)23)28-22(30)29-21-14-26-18(11-24)13-27-21/h2-6,9-10,13-14,25H,7-8,12H2,1H3,(H2,27,28,29,30)
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n/an/a 11n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120880
PNG
(US8716287, 13)
Show SMILES Clc1cccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c1
Show InChI InChI=1S/C21H18Cl2N6O/c22-16-3-1-2-14(8-16)11-25-7-6-15-4-5-17(9-19(15)23)28-21(30)29-20-13-26-18(10-24)12-27-20/h1-5,8-9,12-13,25H,6-7,11H2,(H2,27,28,29,30)
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n/an/a 37n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120882
PNG
(US8716287, 15)
Show SMILES COc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1
Show InChI InChI=1S/C22H21ClN6O2/c1-31-19-6-2-15(3-7-19)12-25-9-8-16-4-5-17(10-20(16)23)28-22(30)29-21-14-26-18(11-24)13-27-21/h2-7,10,13-14,25H,8-9,12H2,1H3,(H2,27,28,29,30)
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n/an/a 3.5n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120884
PNG
(US8716287, 17)
Show SMILES FC(F)(F)c1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1
Show InChI InChI=1S/C22H18ClF3N6O/c23-19-9-17(31-21(33)32-20-13-29-18(10-27)12-30-20)6-3-15(19)7-8-28-11-14-1-4-16(5-2-14)22(24,25)26/h1-6,9,12-13,28H,7-8,11H2,(H2,30,31,32,33)
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n/an/a 78n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120885
PNG
(US8716287, 18)
Show SMILES C[C@H](NCCc1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1Cl)c1ccc(F)cc1
Show InChI InChI=1/C22H20ClFN6O/c1-14(15-2-5-17(24)6-3-15)26-9-8-16-4-7-18(10-20(16)23)29-22(31)30-21-13-27-19(11-25)12-28-21/h2-7,10,12-14,26H,8-9H2,1H3,(H2,28,29,30,31)/t14-/s2
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n/an/a 21n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120886
PNG
(US8716287, 19)
Show SMILES COc1cc(CCNCc2cccc(F)c2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N
Show InChI InChI=1S/C22H20ClFN6O2/c1-32-20-8-15(5-6-26-11-14-3-2-4-16(24)7-14)18(23)9-19(20)29-22(31)30-21-13-27-17(10-25)12-28-21/h2-4,7-9,12-13,26H,5-6,11H2,1H3,(H2,28,29,30,31)
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n/an/a 1.20n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Chk1


(Homo sapiens (Human))
BDBM120870
PNG
(US8716287, 3)
Show SMILES Fc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2)c(F)c1
Show InChI InChI=1S/C21H18F2N6O/c22-16-4-3-15(19(23)9-16)11-25-8-7-14-1-5-17(6-2-14)28-21(30)29-20-13-26-18(10-24)12-27-20/h1-6,9,12-13,25H,7-8,11H2,(H2,27,28,29,30)
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n/an/a 179n/an/an/an/a7.5n/a



Sentinel Oncology Limited

US Patent


Assay Description
The compounds of the invention were tested for activity against Chk-1 kinase using the materials and protocols set out below. Reaction Buffer: Base R...


US Patent US8716287 (2014)


BindingDB Entry DOI: 10.7270/Q2TD9W0C
More data for this
Ligand-Target Pair