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Compile Data Set for Download or QSAR

Found 646 hits of ph data with Target = 'Interleukin-1 receptor-associated kinase 4'   
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
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187398
PNG
(US9169252, 1)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(ccc12)C#N
Show InChI InChI=1S/C23H26FN5O2/c1-14(2)28-18-10-21(29-8-7-16-9-15(11-25)5-6-19(16)29)26-12-17(18)22(30)27-13-20(24)23(3,4)31/h5-10,12,14,20,31H,13H2,1-4H3,(H,26,28)(H,27,30)/t20-/m1/s1
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n/an/a 3.30n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187401
PNG
(US9169252, 2)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CC1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C22H23FN6O2/c1-22(2,31)18(23)12-27-21(30)16-11-25-19(8-17(16)28-15-3-4-15)29-6-5-14-7-13(9-24)10-26-20(14)29/h5-8,10-11,15,18,31H,3-4,12H2,1-2H3,(H,25,28)(H,27,30)/t18-/m1/s1
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n/an/a 1.60n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187402
PNG
(US9169252, 3)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCOCC1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H27FN6O3/c1-24(2,33)20(25)14-29-23(32)18-13-27-21(10-19(18)30-17-4-7-34-8-5-17)31-6-3-16-9-15(11-26)12-28-22(16)31/h3,6,9-10,12-13,17,20,33H,4-5,7-8,14H2,1-2H3,(H,27,30)(H,29,32)/t20-/m1/s1
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n/an/a 1n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187403
PNG
(US9169252, 4)
Show SMILES CCNc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C21H23FN6O2/c1-4-24-16-8-18(28-6-5-14-7-13(9-23)10-26-19(14)28)25-11-15(16)20(29)27-12-17(22)21(2,3)30/h5-8,10-11,17,30H,4,12H2,1-3H3,(H,24,25)(H,27,29)/t17-/m1/s1
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n/an/a 1.40n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187404
PNG
(US9169252, 5)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NCC(F)(F)F)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C21H20F4N6O2/c1-20(2,33)16(22)10-29-19(32)14-9-27-17(6-15(14)30-11-21(23,24)25)31-4-3-13-5-12(7-26)8-28-18(13)31/h3-6,8-9,16,33H,10-11H2,1-2H3,(H,27,30)(H,29,32)/t16-/m1/s1
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n/an/a 2.30n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187405
PNG
(US9169252, 6)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C23H25FN6O2/c1-23(2,32)19(24)13-28-22(31)17-12-26-20(9-18(17)29-16-4-3-5-16)30-7-6-15-8-14(10-25)11-27-21(15)30/h6-9,11-12,16,19,32H,3-5,13H2,1-2H3,(H,26,29)(H,28,31)/t19-/m1/s1
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n/an/a 1n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187406
PNG
(US9169252, 7 | US9169252, 8)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCCOC1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H27FN6O3/c1-24(2,33)20(25)13-29-23(32)18-12-27-21(9-19(18)30-17-4-3-7-34-14-17)31-6-5-16-8-15(10-26)11-28-22(16)31/h5-6,8-9,11-12,17,20,33H,3-4,7,13-14H2,1-2H3,(H,27,30)(H,29,32)/t17?,20-/m1/s1
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n/an/a 1.60n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187406
PNG
(US9169252, 7 | US9169252, 8)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCCOC1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H27FN6O3/c1-24(2,33)20(25)13-29-23(32)18-12-27-21(9-19(18)30-17-4-3-7-34-14-17)31-6-5-16-8-15(10-26)11-28-22(16)31/h5-6,8-9,11-12,17,20,33H,3-4,7,13-14H2,1-2H3,(H,27,30)(H,29,32)/t17?,20-/m1/s1
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n/an/a 1.70n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187408
PNG
(US9169252, 9)
Show SMILES C[C@@H](CO)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C22H25FN6O3/c1-13(12-30)28-17-7-19(29-5-4-15-6-14(8-24)9-26-20(15)29)25-10-16(17)21(31)27-11-18(23)22(2,3)32/h4-7,9-10,13,18,30,32H,11-12H2,1-3H3,(H,25,28)(H,27,31)/t13-,18+/m0/s1
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n/an/a 1.5n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187409
PNG
(US9169252, 10)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCCC1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H27FN6O2/c1-24(2,33)20(25)14-29-23(32)18-13-27-21(10-19(18)30-17-5-3-4-6-17)31-8-7-16-9-15(11-26)12-28-22(16)31/h7-10,12-13,17,20,33H,3-6,14H2,1-2H3,(H,27,30)(H,29,32)/t20-/m1/s1
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n/an/a 1.80n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187410
PNG
(US9169252, 11)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NCCC(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C22H26N6O2/c1-14(2)27-18-10-19(25-13-17(18)21(29)24-7-6-22(3,4)30)28-8-5-16-9-15(11-23)12-26-20(16)28/h5,8-10,12-14,30H,6-7H2,1-4H3,(H,24,29)(H,25,27)
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n/an/a 1.70n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187411
PNG
(US9169252, 12)
Show SMILES CC(C)(O)CCNC(=O)c1cnc(cc1NC1CCOCC1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H28N6O3/c1-24(2,32)6-7-26-23(31)19-15-27-21(12-20(19)29-18-4-9-33-10-5-18)30-8-3-17-11-16(13-25)14-28-22(17)30/h3,8,11-12,14-15,18,32H,4-7,9-10H2,1-2H3,(H,26,31)(H,27,29)
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n/an/a 1.70n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187412
PNG
(US9169252, 13)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC12CC3CC(CC(C3)C1)C2)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C29H33FN6O2/c1-28(2,38)24(30)16-34-27(37)22-15-32-25(36-4-3-21-8-20(13-31)14-33-26(21)36)9-23(22)35-29-10-17-5-18(11-29)7-19(6-17)12-29/h3-4,8-9,14-15,17-19,24,38H,5-7,10-12,16H2,1-2H3,(H,32,35)(H,34,37)/t17?,18?,19?,24-,29?/m1/s1
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n/an/a 12n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187413
PNG
(US9169252, 14 | US9169252, 415)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC12CCC(O)(CC1)C2)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H26N6O2/c1-15(2)28-19-10-20(30-8-3-17-9-16(11-25)12-27-21(17)30)26-13-18(19)22(31)29-23-4-6-24(32,14-23)7-5-23/h3,8-10,12-13,15,32H,4-7,14H2,1-2H3,(H,26,28)(H,29,31)
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n/an/a 14.8n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187414
PNG
(US9169252, 15 | US9169252, 417)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NCCCOC(C)(C)C)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H30N6O2/c1-16(2)29-20-12-21(30-9-7-18-11-17(13-25)14-28-22(18)30)27-15-19(20)23(31)26-8-6-10-32-24(3,4)5/h7,9,11-12,14-16H,6,8,10H2,1-5H3,(H,26,31)(H,27,29)
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n/an/a 5.5n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187415
PNG
(US9169252, 16)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC12CCC(O)(CC1)C2)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C26H29FN6O3/c1-24(2,35)20(27)14-31-23(34)18-13-29-21(33-8-3-17-9-16(11-28)12-30-22(17)33)10-19(18)32-25-4-6-26(36,15-25)7-5-25/h3,8-10,12-13,20,35-36H,4-7,14-15H2,1-2H3,(H,29,32)(H,31,34)/t20-,25?,26?/m1/s1
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n/an/a 1.20n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187416
PNG
(US9169252, 17)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1(C)CC1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C23H25FN6O2/c1-22(2,32)18(24)13-28-21(31)16-12-26-19(9-17(16)29-23(3)5-6-23)30-7-4-15-8-14(10-25)11-27-20(15)30/h4,7-9,11-12,18,32H,5-6,13H2,1-3H3,(H,26,29)(H,28,31)/t18-/m1/s1
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n/an/a 1.20n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187417
PNG
(US9169252, 18)
Show SMILES CCCNc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C22H25FN6O2/c1-4-6-25-17-9-19(29-7-5-15-8-14(10-24)11-27-20(15)29)26-12-16(17)21(30)28-13-18(23)22(2,3)31/h5,7-9,11-12,18,31H,4,6,13H2,1-3H3,(H,25,26)(H,28,30)/t18-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187418
PNG
(US9169252, 19)
Show SMILES CC(C)CCNc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H29FN6O2/c1-15(2)5-7-27-19-10-21(31-8-6-17-9-16(11-26)12-29-22(17)31)28-13-18(19)23(32)30-14-20(25)24(3,4)33/h6,8-10,12-13,15,20,33H,5,7,14H2,1-4H3,(H,27,28)(H,30,32)/t20-/m1/s1
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n/an/a 3.20n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187419
PNG
(US9169252, 20)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NCC1(C)COC1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H27FN6O3/c1-23(2,33)19(25)11-29-22(32)17-10-27-20(7-18(17)30-12-24(3)13-34-14-24)31-5-4-16-6-15(8-26)9-28-21(16)31/h4-7,9-10,19,33H,11-14H2,1-3H3,(H,27,30)(H,29,32)/t19-/m1/s1
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n/an/a 5.70n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187420
PNG
(US9169252, 21 | US9169252, 22)
Show SMILES CC(CCO)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C23H27FN6O3/c1-14(5-7-31)29-18-9-20(30-6-4-16-8-15(10-25)11-27-21(16)30)26-12-17(18)22(32)28-13-19(24)23(2,3)33/h4,6,8-9,11-12,14,19,31,33H,5,7,13H2,1-3H3,(H,26,29)(H,28,32)/t14?,19-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187420
PNG
(US9169252, 21 | US9169252, 22)
Show SMILES CC(CCO)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C23H27FN6O3/c1-14(5-7-31)29-18-9-20(30-6-4-16-8-15(10-25)11-27-21(16)30)26-12-17(18)22(32)28-13-19(24)23(2,3)33/h4,6,8-9,11-12,14,19,31,33H,5,7,13H2,1-3H3,(H,26,29)(H,28,32)/t14?,19-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187422
PNG
(US9169252, 23)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@H](F)C(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C22H25FN6O2/c1-13(2)28-17-8-19(29-6-5-15-7-14(9-24)10-26-20(15)29)25-11-16(17)21(30)27-12-18(23)22(3,4)31/h5-8,10-11,13,18,31H,12H2,1-4H3,(H,25,28)(H,27,30)/t18-/m0/s1
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Bristol-Myers Squibb Company

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))
BDBM187423
PNG
(US9169252, 24 | US9169252, 25 | US9169252, 26 | US...)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(O)C1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H27FN6O3/c1-24(2,34)20(25)13-29-23(33)18-12-27-21(9-19(18)30-16-3-4-17(32)8-16)31-6-5-15-7-14(10-26)11-28-22(15)31/h5-7,9,11-12,16-17,20,32,34H,3-4,8,13H2,1-2H3,(H,27,30)(H,29,33)/t16?,17?,20-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187423
PNG
(US9169252, 24 | US9169252, 25 | US9169252, 26 | US...)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(O)C1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H27FN6O3/c1-24(2,34)20(25)13-29-23(33)18-12-27-21(9-19(18)30-16-3-4-17(32)8-16)31-6-5-15-7-14(10-26)11-28-22(15)31/h5-7,9,11-12,16-17,20,32,34H,3-4,8,13H2,1-2H3,(H,27,30)(H,29,33)/t16?,17?,20-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187423
PNG
(US9169252, 24 | US9169252, 25 | US9169252, 26 | US...)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(O)C1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H27FN6O3/c1-24(2,34)20(25)13-29-23(33)18-12-27-21(9-19(18)30-16-3-4-17(32)8-16)31-6-5-15-7-14(10-26)11-28-22(15)31/h5-7,9,11-12,16-17,20,32,34H,3-4,8,13H2,1-2H3,(H,27,30)(H,29,33)/t16?,17?,20-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187423
PNG
(US9169252, 24 | US9169252, 25 | US9169252, 26 | US...)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC(O)C1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H27FN6O3/c1-24(2,34)20(25)13-29-23(33)18-12-27-21(9-19(18)30-16-3-4-17(32)8-16)31-6-5-15-7-14(10-26)11-28-22(15)31/h5-7,9,11-12,16-17,20,32,34H,3-4,8,13H2,1-2H3,(H,27,30)(H,29,33)/t16?,17?,20-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187430
PNG
(US9169252, 31)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCC1)-n1ccc2cc(Cl)cnc12
Show InChI InChI=1S/C22H25ClFN5O2/c1-22(2,31)18(24)12-27-21(30)16-11-25-19(9-17(16)28-15-4-3-5-15)29-7-6-13-8-14(23)10-26-20(13)29/h6-11,15,18,31H,3-5,12H2,1-2H3,(H,25,28)(H,27,30)/t18-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187431
PNG
(US9169252, 32)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCOCC1)-n1ccc2cc(Cl)cnc12
Show InChI InChI=1S/C23H27ClFN5O3/c1-23(2,32)19(25)13-28-22(31)17-12-26-20(10-18(17)29-16-4-7-33-8-5-16)30-6-3-14-9-15(24)11-27-21(14)30/h3,6,9-12,16,19,32H,4-5,7-8,13H2,1-2H3,(H,26,29)(H,28,31)/t19-/m1/s1
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n/an/a 1.90n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187432
PNG
(US9169252, 33)
Show SMILES CCNc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(Cl)cnc12
Show InChI InChI=1S/C20H23ClFN5O2/c1-4-23-15-8-17(27-6-5-12-7-13(21)9-25-18(12)27)24-10-14(15)19(28)26-11-16(22)20(2,3)29/h5-10,16,29H,4,11H2,1-3H3,(H,23,24)(H,26,28)/t16-/m1/s1
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n/an/a 7.10n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187433
PNG
(US9169252, 34)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CC1)-n1ccc2cc(Cl)cnc12
Show InChI InChI=1S/C21H23ClFN5O2/c1-21(2,30)17(23)11-26-20(29)15-10-24-18(8-16(15)27-14-3-4-14)28-6-5-12-7-13(22)9-25-19(12)28/h5-10,14,17,30H,3-4,11H2,1-2H3,(H,24,27)(H,26,29)/t17-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187434
PNG
(US9169252, 35)
Show SMILES CC(C)(O)CNc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(Cl)cnc12
Show InChI InChI=1S/C22H27ClFN5O3/c1-21(2,31)12-28-16-8-18(29-6-5-13-7-14(23)9-26-19(13)29)25-10-15(16)20(30)27-11-17(24)22(3,4)32/h5-10,17,31-32H,11-12H2,1-4H3,(H,25,28)(H,27,30)/t17-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187435
PNG
(US9169252, 36)
Show SMILES CC(C)(O)CCNC(=O)c1cnc(cc1NC1CCOCC1)-n1ccc2cc(Cl)cnc12
Show InChI InChI=1S/C23H28ClN5O3/c1-23(2,31)6-7-25-22(30)18-14-26-20(12-19(18)28-17-4-9-32-10-5-17)29-8-3-15-11-16(24)13-27-21(15)29/h3,8,11-14,17,31H,4-7,9-10H2,1-2H3,(H,25,30)(H,26,28)
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Bristol-Myers Squibb Company

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))
BDBM187436
PNG
(US9169252, 37)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(Cl)ccc12
Show InChI InChI=1S/C22H26ClFN4O2/c1-13(2)27-17-10-20(28-8-7-14-9-15(23)5-6-18(14)28)25-11-16(17)21(29)26-12-19(24)22(3,4)30/h5-11,13,19,30H,12H2,1-4H3,(H,25,27)(H,26,29)/t19-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187437
PNG
(US9169252, 38)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(F)cnc12
Show InChI InChI=1S/C21H25F2N5O2/c1-12(2)27-16-8-18(28-6-5-13-7-14(22)9-25-19(13)28)24-10-15(16)20(29)26-11-17(23)21(3,4)30/h5-10,12,17,30H,11H2,1-4H3,(H,24,27)(H,26,29)/t17-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187438
PNG
(US9169252, 39)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cncnc12
Show InChI InChI=1S/C20H25FN6O2/c1-12(2)26-15-7-17(27-6-5-13-8-22-11-25-18(13)27)23-9-14(15)19(28)24-10-16(21)20(3,4)29/h5-9,11-12,16,29H,10H2,1-4H3,(H,23,26)(H,24,28)/t16-/m1/s1
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Bristol-Myers Squibb Company

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))
BDBM187439
PNG
(US9169252, 40)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCOCC1)-n1ccc2cncnc12
Show InChI InChI=1S/C22H27FN6O3/c1-22(2,31)18(23)12-26-21(30)16-11-25-19(9-17(16)28-15-4-7-32-8-5-15)29-6-3-14-10-24-13-27-20(14)29/h3,6,9-11,13,15,18,31H,4-5,7-8,12H2,1-2H3,(H,25,28)(H,26,30)/t18-/m1/s1
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n/an/a 2n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187440
PNG
(US9169252, 41)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CC1)-n1ccc2cncnc12
Show InChI InChI=1S/C20H23FN6O2/c1-20(2,29)16(21)10-24-19(28)14-9-23-17(7-15(14)26-13-3-4-13)27-6-5-12-8-22-11-25-18(12)27/h5-9,11,13,16,29H,3-4,10H2,1-2H3,(H,23,26)(H,24,28)/t16-/m1/s1
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n/an/a 1.90n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187441
PNG
(US9169252, 42)
Show SMILES CC(C)(O)CNc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cncnc12
Show InChI InChI=1S/C21H27FN6O3/c1-20(2,30)11-26-15-7-17(28-6-5-13-8-23-12-27-18(13)28)24-9-14(15)19(29)25-10-16(22)21(3,4)31/h5-9,12,16,30-31H,10-11H2,1-4H3,(H,24,26)(H,25,29)/t16-/m1/s1
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n/an/a 13.6n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187442
PNG
(US9169252, 43)
Show SMILES CC(C)(O)CCNC(=O)c1cnc(cc1NC1CCOCC1)-n1ccc2cncnc12
Show InChI InChI=1S/C22H28N6O3/c1-22(2,30)6-7-24-21(29)17-13-25-19(11-18(17)27-16-4-9-31-10-5-16)28-8-3-15-12-23-14-26-20(15)28/h3,8,11-14,16,30H,4-7,9-10H2,1-2H3,(H,24,29)(H,25,27)
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n/an/a 6n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187443
PNG
(US9169252, 44)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NCCC(C)(C)O)-n1ccc2cncnc12
Show InChI InChI=1S/C20H26N6O2/c1-13(2)25-16-9-17(26-8-5-14-10-21-12-24-18(14)26)23-11-15(16)19(27)22-7-6-20(3,4)28/h5,8-13,28H,6-7H2,1-4H3,(H,22,27)(H,23,25)
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n/an/a 4.20n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187444
PNG
(US9169252, 45)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(NC(C)=O)cnc12
Show InChI InChI=1S/C23H29FN6O3/c1-13(2)28-18-9-20(25-11-17(18)22(32)27-12-19(24)23(4,5)33)30-7-6-15-8-16(29-14(3)31)10-26-21(15)30/h6-11,13,19,33H,12H2,1-5H3,(H,25,28)(H,27,32)(H,29,31)/t19-/m1/s1
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n/an/a 23.2n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187445
PNG
(US9169252, 46)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1Nc1cccc(O)c1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C25H23FN6O3/c1-25(2,35)21(26)14-30-24(34)19-13-28-22(10-20(19)31-17-4-3-5-18(33)9-17)32-7-6-16-8-15(11-27)12-29-23(16)32/h3-10,12-13,21,33,35H,14H2,1-2H3,(H,28,31)(H,30,34)/t21-/m1/s1
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n/an/a 2.20n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187446
PNG
(US9169252, 47)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NCCCOC(C)C)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C23H28N6O2/c1-15(2)28-20-11-21(29-8-6-18-10-17(12-24)13-27-22(18)29)26-14-19(20)23(30)25-7-5-9-31-16(3)4/h6,8,10-11,13-16H,5,7,9H2,1-4H3,(H,25,30)(H,26,28)
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n/an/a 5.60n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187447
PNG
(US9169252, 48 | US9169252, 49)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C21H23FN6O2/c1-12(2)27-18-7-19(24-10-16(18)21(30)26-11-17(22)13(3)29)28-5-4-15-6-14(8-23)9-25-20(15)28/h4-7,9-10,12-13,17,29H,11H2,1-3H3,(H,24,27)(H,26,30)/t13?,17-/m1/s1
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n/an/a 1.40n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187447
PNG
(US9169252, 48 | US9169252, 49)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C21H23FN6O2/c1-12(2)27-18-7-19(24-10-16(18)21(30)26-11-17(22)13(3)29)28-5-4-15-6-14(8-23)9-25-20(15)28/h4-7,9-10,12-13,17,29H,11H2,1-3H3,(H,24,27)(H,26,30)/t13?,17-/m1/s1
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n/an/a 3.20n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187449
PNG
(US9169252, 416 | US9169252, 50)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1Nc1cccc(c1)S(N)(=O)=O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C25H24FN7O4S/c1-25(2,35)21(26)14-31-24(34)19-13-29-22(33-7-6-16-8-15(11-27)12-30-23(16)33)10-20(19)32-17-4-3-5-18(9-17)38(28,36)37/h3-10,12-13,21,35H,14H2,1-2H3,(H,29,32)(H,31,34)(H2,28,36,37)/t21-/m1/s1
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n/an/a 1.90n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187450
PNG
(US9169252, 418 | US9169252, 51)
Show SMILES COc1cccc(Nc2cc(ncc2C(=O)NC[C@@H](F)C(C)(C)O)-n2ccc3cc(cnc23)C#N)c1
Show InChI InChI=1S/C26H25FN6O3/c1-26(2,35)22(27)15-31-25(34)20-14-29-23(11-21(20)32-18-5-4-6-19(10-18)36-3)33-8-7-17-9-16(12-28)13-30-24(17)33/h4-11,13-14,22,35H,15H2,1-3H3,(H,29,32)(H,31,34)/t22-/m1/s1
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n/an/a 4.40n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187451
PNG
(US9169252, 52)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC[C@@H](F)C(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C24H28F2N6O3/c1-23(2,34)18(25)12-28-17-8-20(32-6-5-15-7-14(9-27)10-30-21(15)32)29-11-16(17)22(33)31-13-19(26)24(3,4)35/h5-8,10-11,18-19,34-35H,12-13H2,1-4H3,(H,28,29)(H,31,33)/t18-,19-/m1/s1
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n/an/a 2.40n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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))
BDBM187452
PNG
(US9169252, 53)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CC(F)(F)C1)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1S/C23H23F3N6O2/c1-22(2,34)18(24)12-30-21(33)16-11-28-19(6-17(16)31-15-7-23(25,26)8-15)32-4-3-14-5-13(9-27)10-29-20(14)32/h3-6,10-11,15,18,34H,7-8,12H2,1-2H3,(H,28,31)(H,30,33)/t18-/m1/s1
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n/an/a 1.90n/an/an/an/a7.2n/a



Bristol-Myers Squibb Company

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
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