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142 similar compounds to monomer 187592

Compile data set for download or QSAR
Wt: 453.4
BDBM188111
Wt: 425.4
BDBM187563
Wt: 439.4
BDBM187681
Wt: 487.4
BDBM188083
Wt: 423.4
BDBM187575
Wt: 469.4
BDBM188094
Wt: 462.4
BDBM188087
Wt: 466.5
BDBM188107
Wt: 460.4
BDBM188078
Wt: 467.4
BDBM187578
Wt: 548.5
BDBM187992
Wt: 453.4
BDBM188005
Wt: 462.9
BDBM188114
Wt: 478.9
BDBM188060
Wt: 439.4
BDBM187692
Displayed 1 to 15 (of 142 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 36 hits for monomerid = 188111,187563,187681,188083,187575,188094,188087,188107,188078,187578,187992,188005,188114,188060,187692   
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
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187563
PNG
(US9169252, 133 | US9169252, 335)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C21H24FN7O2/c1-12(2)28-16-6-18(29-19-14(9-27-29)5-13(7-23)8-25-19)24-10-15(16)20(30)26-11-17(22)21(3,4)31/h5-6,8-10,12,17,31H,11H2,1-4H3,(H,24,28)(H,26,30)/t17-/s2
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n/an/a 2.60n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188114
PNG
(US9169252, 645 | US9169252, 646)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1N[C@@H]1C[C@H]1CO)-n1ncc2cc(Cl)cnc12
Show InChI InChI=1/C21H24ClFN6O3/c1-21(2,32)17(23)9-26-20(31)14-8-24-18(5-16(14)28-15-4-12(15)10-30)29-19-11(6-27-29)3-13(22)7-25-19/h3,5-8,12,15,17,30,32H,4,9-10H2,1-2H3,(H,24,28)(H,26,31)/t12-,15+,17+/s2
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n/an/a 10.5n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187578
PNG
(US9169252, 142 | US9169252, 143)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCCOC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H26FN7O3/c1-23(2,33)19(24)12-28-22(32)17-11-26-20(7-18(17)30-16-4-3-5-34-13-16)31-21-15(10-29-31)6-14(8-25)9-27-21/h6-7,9-11,16,19,33H,3-5,12-13H2,1-2H3,(H,26,30)(H,28,32)/t16?,19-/s2
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n/an/a 11.4n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187578
PNG
(US9169252, 142 | US9169252, 143)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCCOC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H26FN7O3/c1-23(2,33)19(24)12-28-22(32)17-11-26-20(7-18(17)30-16-4-3-5-34-13-16)31-21-15(10-29-31)6-14(8-25)9-27-21/h6-7,9-11,16,19,33H,3-5,12-13H2,1-2H3,(H,26,30)(H,28,32)/t16?,19-/s2
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n/an/a 6.5n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187681
PNG
(US9169252, 232 | US9169252, 233)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(O)C(C)C)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C22H26FN7O2/c1-12(2)20(31)17(23)11-27-22(32)16-10-25-19(6-18(16)29-13(3)4)30-21-15(9-28-30)5-14(7-24)8-26-21/h5-6,8-10,12-13,17,20,31H,11H2,1-4H3,(H,25,29)(H,27,32)/t17-,20?/s2
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n/an/a 2.30n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187681
PNG
(US9169252, 232 | US9169252, 233)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(O)C(C)C)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C22H26FN7O2/c1-12(2)20(31)17(23)11-27-22(32)16-10-25-19(6-18(16)29-13(3)4)30-21-15(9-28-30)5-14(7-24)8-26-21/h5-6,8-10,12-13,17,20,31H,11H2,1-4H3,(H,25,29)(H,27,32)/t17-,20?/s2
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n/an/a 3.60n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187692
PNG
(US9169252, 243 | US9169252, 248 | US9169252, 249)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NCC(F)C1(O)COC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C21H22FN7O3/c1-12(2)28-16-4-18(29-19-14(7-27-29)3-13(5-23)6-25-19)24-8-15(16)20(30)26-9-17(22)21(31)10-32-11-21/h3-4,6-8,12,17,31H,9-11H2,1-2H3,(H,24,28)(H,26,30)
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n/an/a 5.30n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187692
PNG
(US9169252, 243 | US9169252, 248 | US9169252, 249)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NCC(F)C1(O)COC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C21H22FN7O3/c1-12(2)28-16-4-18(29-19-14(7-27-29)3-13(5-23)6-25-19)24-8-15(16)20(30)26-9-17(22)21(31)10-32-11-21/h3-4,6-8,12,17,31H,9-11H2,1-2H3,(H,24,28)(H,26,30)
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n/an/a 3.60n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187692
PNG
(US9169252, 243 | US9169252, 248 | US9169252, 249)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NCC(F)C1(O)COC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C21H22FN7O3/c1-12(2)28-16-4-18(29-19-14(7-27-29)3-13(5-23)6-25-19)24-8-15(16)20(30)26-9-17(22)21(31)10-32-11-21/h3-4,6-8,12,17,31H,9-11H2,1-2H3,(H,24,28)(H,26,30)
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n/an/a 6.10n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187563
PNG
(US9169252, 133 | US9169252, 335)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C21H24FN7O2/c1-12(2)28-16-6-18(29-19-14(9-27-29)5-13(7-23)8-25-19)24-10-15(16)20(30)26-11-17(22)21(3,4)31/h5-6,8-10,12,17,31H,11H2,1-4H3,(H,24,28)(H,26,30)/t17-/s2
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n/an/a 3.30n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187575
PNG
(US9169252, 139 | US9169252, 336)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C21H22FN7O2/c1-21(2,31)17(22)11-26-20(30)15-10-24-18(6-16(15)28-14-3-4-14)29-19-13(9-27-29)5-12(7-23)8-25-19/h5-6,8-10,14,17,31H,3-4,11H2,1-2H3,(H,24,28)(H,26,30)/t17-/s2
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n/an/a 3.80n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187992
PNG
(US9169252, 532 | US9169252, 534)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1N[C@@H]1CCN(C1)c1ncc(F)cn1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C26H26F2N10O2/c1-26(2,40)21(28)13-32-24(39)19-12-30-22(38-23-16(9-35-38)5-15(7-29)8-31-23)6-20(19)36-18-3-4-37(14-18)25-33-10-17(27)11-34-25/h5-6,8-12,18,21,40H,3-4,13-14H2,1-2H3,(H,30,36)(H,32,39)/t18-,21-/s2
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n/an/a 5.5n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187992
PNG
(US9169252, 532 | US9169252, 534)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1N[C@@H]1CCN(C1)c1ncc(F)cn1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C26H26F2N10O2/c1-26(2,40)21(28)13-32-24(39)19-12-30-22(38-23-16(9-35-38)5-15(7-29)8-31-23)6-20(19)36-18-3-4-37(14-18)25-33-10-17(27)11-34-25/h5-6,8-12,18,21,40H,3-4,13-14H2,1-2H3,(H,30,36)(H,32,39)/t18-,21-/s2
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n/an/a 1.5n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188005
PNG
(US9169252, 544 | US9169252, 548)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1N[C@@H]1CCOC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C22H24FN7O3/c1-22(2,32)18(23)11-27-21(31)16-10-25-19(6-17(16)29-15-3-4-33-12-15)30-20-14(9-28-30)5-13(7-24)8-26-20/h5-6,8-10,15,18,32H,3-4,11-12H2,1-2H3,(H,25,29)(H,27,31)/t15-,18-/s2
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n/an/a 4.10n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188005
PNG
(US9169252, 544 | US9169252, 548)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1N[C@@H]1CCOC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C22H24FN7O3/c1-22(2,32)18(23)11-27-21(31)16-10-25-19(6-17(16)29-15-3-4-33-12-15)30-20-14(9-28-30)5-13(7-24)8-26-20/h5-6,8-10,15,18,32H,3-4,11-12H2,1-2H3,(H,25,29)(H,27,31)/t15-,18-/s2
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n/an/a 10.6n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188060
PNG
(US9169252, 594 | US9169252, 596)
Show SMILES CC(C)C(O)CNc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ncc2cc(Cl)cnc12
Show InChI InChI=1/C22H28ClFN6O3/c1-12(2)17(31)10-25-16-6-19(30-20-13(7-29-30)5-14(23)8-27-20)26-9-15(16)21(32)28-11-18(24)22(3,4)33/h5-9,12,17-18,31,33H,10-11H2,1-4H3,(H,25,26)(H,28,32)/t17?,18-/s2
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n/an/a 17.5n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188060
PNG
(US9169252, 594 | US9169252, 596)
Show SMILES CC(C)C(O)CNc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ncc2cc(Cl)cnc12
Show InChI InChI=1/C22H28ClFN6O3/c1-12(2)17(31)10-25-16-6-19(30-20-13(7-29-30)5-14(23)8-27-20)26-9-15(16)21(32)28-11-18(24)22(3,4)33/h5-9,12,17-18,31,33H,10-11H2,1-4H3,(H,25,26)(H,28,32)/t17?,18-/s2
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n/an/a 18.2n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188078
PNG
(US9169252, 609 | US9169252, 610 | US9169252, 611)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(O)C1)-n1ncc2cc(F)cnc12
Show InChI InChI=1/C22H26F2N6O3/c1-22(2,33)18(24)11-27-21(32)16-10-25-19(7-17(16)29-14-3-4-15(31)6-14)30-20-12(8-28-30)5-13(23)9-26-20/h5,7-10,14-15,18,31,33H,3-4,6,11H2,1-2H3,(H,25,29)(H,27,32)/t14?,15?,18-/s2
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n/an/a 22.7n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188078
PNG
(US9169252, 609 | US9169252, 610 | US9169252, 611)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(O)C1)-n1ncc2cc(F)cnc12
Show InChI InChI=1/C22H26F2N6O3/c1-22(2,33)18(24)11-27-21(32)16-10-25-19(7-17(16)29-14-3-4-15(31)6-14)30-20-12(8-28-30)5-13(23)9-26-20/h5,7-10,14-15,18,31,33H,3-4,6,11H2,1-2H3,(H,25,29)(H,27,32)/t14?,15?,18-/s2
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n/an/a 8.90n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188078
PNG
(US9169252, 609 | US9169252, 610 | US9169252, 611)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(O)C1)-n1ncc2cc(F)cnc12
Show InChI InChI=1/C22H26F2N6O3/c1-22(2,33)18(24)11-27-21(32)16-10-25-19(7-17(16)29-14-3-4-15(31)6-14)30-20-12(8-28-30)5-13(23)9-26-20/h5,7-10,14-15,18,31,33H,3-4,6,11H2,1-2H3,(H,25,29)(H,27,32)/t14?,15?,18-/s2
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n/an/a 17.4n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188083
PNG
(US9169252, 614 | US9169252, 615)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(F)(F)C1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H24F3N7O2/c1-22(2,35)18(24)12-30-21(34)16-11-28-19(6-17(16)32-15-3-4-23(25,26)7-15)33-20-14(10-31-33)5-13(8-27)9-29-20/h5-6,9-11,15,18,35H,3-4,7,12H2,1-2H3,(H,28,32)(H,30,34)/t15?,18-/s2
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n/an/a 7.70n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188083
PNG
(US9169252, 614 | US9169252, 615)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(F)(F)C1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H24F3N7O2/c1-22(2,35)18(24)12-30-21(34)16-11-28-19(6-17(16)32-15-3-4-23(25,26)7-15)33-20-14(10-31-33)5-13(8-27)9-29-20/h5-6,9-11,15,18,35H,3-4,7,12H2,1-2H3,(H,28,32)(H,30,34)/t15?,18-/s2
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n/an/a 2.30n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188087
PNG
(US9169252, 618 | US9169252, 619 | US9169252, 620 |...)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(F)C1)-n1ncc2cc(F)cnc12
Show InChI InChI=1/C22H25F3N6O2/c1-22(2,33)18(25)11-28-21(32)16-10-26-19(7-17(16)30-15-4-3-13(23)6-15)31-20-12(8-29-31)5-14(24)9-27-20/h5,7-10,13,15,18,33H,3-4,6,11H2,1-2H3,(H,26,30)(H,28,32)/t13?,15?,18-/s2
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n/an/a 5.80n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188087
PNG
(US9169252, 618 | US9169252, 619 | US9169252, 620 |...)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(F)C1)-n1ncc2cc(F)cnc12
Show InChI InChI=1/C22H25F3N6O2/c1-22(2,33)18(25)11-28-21(32)16-10-26-19(7-17(16)30-15-4-3-13(23)6-15)31-20-12(8-29-31)5-14(24)9-27-20/h5,7-10,13,15,18,33H,3-4,6,11H2,1-2H3,(H,26,30)(H,28,32)/t13?,15?,18-/s2
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n/an/a 4n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188087
PNG
(US9169252, 618 | US9169252, 619 | US9169252, 620 |...)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(F)C1)-n1ncc2cc(F)cnc12
Show InChI InChI=1/C22H25F3N6O2/c1-22(2,33)18(25)11-28-21(32)16-10-26-19(7-17(16)30-15-4-3-13(23)6-15)31-20-12(8-29-31)5-14(24)9-27-20/h5,7-10,13,15,18,33H,3-4,6,11H2,1-2H3,(H,26,30)(H,28,32)/t13?,15?,18-/s2
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n/an/a 3.40n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188087
PNG
(US9169252, 618 | US9169252, 619 | US9169252, 620 |...)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(F)C1)-n1ncc2cc(F)cnc12
Show InChI InChI=1/C22H25F3N6O2/c1-22(2,33)18(25)11-28-21(32)16-10-26-19(7-17(16)30-15-4-3-13(23)6-15)31-20-12(8-29-31)5-14(24)9-27-20/h5,7-10,13,15,18,33H,3-4,6,11H2,1-2H3,(H,26,30)(H,28,32)/t13?,15?,18-/s2
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n/an/a 4n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188094
PNG
(US9169252, 625 | US9169252, 626 | US9169252, 627)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(F)C1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H25F2N7O2/c1-23(2,34)19(25)12-29-22(33)17-11-27-20(7-18(17)31-16-4-3-15(24)6-16)32-21-14(10-30-32)5-13(8-26)9-28-21/h5,7,9-11,15-16,19,34H,3-4,6,12H2,1-2H3,(H,27,31)(H,29,33)/t15?,16?,19-/s2
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n/an/a 2.20n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188094
PNG
(US9169252, 625 | US9169252, 626 | US9169252, 627)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(F)C1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H25F2N7O2/c1-23(2,34)19(25)12-29-22(33)17-11-27-20(7-18(17)31-16-4-3-15(24)6-16)32-21-14(10-30-32)5-13(8-26)9-28-21/h5,7,9-11,15-16,19,34H,3-4,6,12H2,1-2H3,(H,27,31)(H,29,33)/t15?,16?,19-/s2
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n/an/a 1.10n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188094
PNG
(US9169252, 625 | US9169252, 626 | US9169252, 627)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(F)C1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H25F2N7O2/c1-23(2,34)19(25)12-29-22(33)17-11-27-20(7-18(17)31-16-4-3-15(24)6-16)32-21-14(10-30-32)5-13(8-26)9-28-21/h5,7,9-11,15-16,19,34H,3-4,6,12H2,1-2H3,(H,27,31)(H,29,33)/t15?,16?,19-/s2
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n/an/a 2.30n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188107
PNG
(US9169252, 638 | US9169252, 639 | US9169252, 640)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(N)C1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H27FN8O2/c1-23(2,34)19(24)12-29-22(33)17-11-27-20(7-18(17)31-16-4-3-15(26)6-16)32-21-14(10-30-32)5-13(8-25)9-28-21/h5,7,9-11,15-16,19,34H,3-4,6,12,26H2,1-2H3,(H,27,31)(H,29,33)/t15?,16?,19-/s2
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n/an/a 11.7n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188107
PNG
(US9169252, 638 | US9169252, 639 | US9169252, 640)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(N)C1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H27FN8O2/c1-23(2,34)19(24)12-29-22(33)17-11-27-20(7-18(17)31-16-4-3-15(26)6-16)32-21-14(10-30-32)5-13(8-25)9-28-21/h5,7,9-11,15-16,19,34H,3-4,6,12,26H2,1-2H3,(H,27,31)(H,29,33)/t15?,16?,19-/s2
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n/an/a 8.5n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188107
PNG
(US9169252, 638 | US9169252, 639 | US9169252, 640)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(N)C1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H27FN8O2/c1-23(2,34)19(24)12-29-22(33)17-11-27-20(7-18(17)31-16-4-3-15(26)6-16)32-21-14(10-30-32)5-13(8-25)9-28-21/h5,7,9-11,15-16,19,34H,3-4,6,12,26H2,1-2H3,(H,27,31)(H,29,33)/t15?,16?,19-/s2
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n/an/a 3.20n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188111
PNG
(US9169252, 642 | US9169252, 643)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1N[C@@H]1C[C@H]1CO)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C22H24FN7O3/c1-22(2,33)18(23)10-27-21(32)15-9-25-19(5-17(15)29-16-4-14(16)11-31)30-20-13(8-28-30)3-12(6-24)7-26-20/h3,5,7-9,14,16,18,31,33H,4,10-11H2,1-2H3,(H,25,29)(H,27,32)/t14-,16+,18+/s2
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n/an/a 4.80n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188111
PNG
(US9169252, 642 | US9169252, 643)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1N[C@@H]1C[C@H]1CO)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C22H24FN7O3/c1-22(2,33)18(23)10-27-21(32)15-9-25-19(5-17(15)29-16-4-14(16)11-31)30-20-13(8-28-30)3-12(6-24)7-26-20/h3,5,7-9,14,16,18,31,33H,4,10-11H2,1-2H3,(H,25,29)(H,27,32)/t14-,16+,18+/s2
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n/an/a 5.40n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM188114
PNG
(US9169252, 645 | US9169252, 646)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1N[C@@H]1C[C@H]1CO)-n1ncc2cc(Cl)cnc12
Show InChI InChI=1/C21H24ClFN6O3/c1-21(2,32)17(23)9-26-20(31)14-8-24-18(5-16(14)28-15-4-12(15)10-30)29-19-11(6-27-29)3-13(22)7-25-19/h3,5-8,12,15,17,30,32H,4,9-10H2,1-2H3,(H,24,28)(H,26,31)/t12-,15+,17+/s2
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US Patent
n/an/a 6.90n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187575
PNG
(US9169252, 139 | US9169252, 336)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C21H22FN7O2/c1-21(2,31)17(22)11-26-20(30)15-10-24-18(6-16(15)28-14-3-4-14)29-19-13(9-27-29)5-12(7-23)8-25-19/h5-6,8-10,14,17,31H,3-4,11H2,1-2H3,(H,24,28)(H,26,30)/t17-/s2
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US Patent
n/an/a 2.90n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair