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28 similar compounds to monomer 187845

Compile data set for download or QSAR
Wt: 451.4
BDBM187846
Wt: 505.5
BDBM187805
Wt: 533.5
BDBM187806
Wt: 519.5
BDBM187807
Wt: 522.9
BDBM187808
Wt: 531.4
BDBM187810
Wt: 540.9
BDBM187811
Wt: 477.4
BDBM187812
Wt: 502.5
BDBM187833
Wt: 491.5
BDBM187837
Wt: 465.4
BDBM187847
Wt: 465.4
BDBM187848
Wt: 481.4
BDBM187849
Wt: 437.4
BDBM187850
Wt: 515.4
BDBM187852
Displayed 1 to 15 (of 28 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 187846,187805,187806,187807,187808,187810,187811,187812,187833,187837,187847,187848,187849,187850,187852   
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))
BDBM187805
PNG
(US9169252, 348)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1Nc1cnn(c1)C1COC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C24H24FN9O3/c1-24(2,36)20(25)10-29-23(35)18-9-27-21(34-22-15(7-31-34)3-14(5-26)6-28-22)4-19(18)32-16-8-30-33(11-16)17-12-37-13-17/h3-4,6-9,11,17,20,36H,10,12-13H2,1-2H3,(H,27,32)(H,29,35)/t20-/s2
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n/an/a 1.80n/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))
BDBM187852
PNG
(US9169252, 395)
Show SMILES CC(C)(F)[C@H](F)CNC(=O)c1cnc(cc1Nc1cnn(CC(F)F)c1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H21F4N9O/c1-23(2,27)18(24)10-31-22(37)16-9-29-20(36-21-14(7-33-36)3-13(5-28)6-30-21)4-17(16)34-15-8-32-35(11-15)12-19(25)26/h3-4,6-9,11,18-19H,10,12H2,1-2H3,(H,29,34)(H,31,37)/t18-/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))
BDBM187807
PNG
(US9169252, 350)
Show SMILES CC(C)(C)Cn1cc(Nc2cc(ncc2C(=O)NC[C@@H](F)C(C)(C)O)-n2ncc3cc(cnc23)C#N)cn1
Show InChI InChI=1/C26H30FN9O2/c1-25(2,3)15-35-14-18(11-32-35)34-20-7-22(36-23-17(10-33-36)6-16(8-28)9-30-23)29-12-19(20)24(37)31-13-21(27)26(4,5)38/h6-7,9-12,14,21,38H,13,15H2,1-5H3,(H,29,34)(H,31,37)/t21-/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))
BDBM187808
PNG
(US9169252, 351)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1Nc1cnn(CC(F)F)c1)-n1ncc2cc(Cl)cnc12
Show InChI InChI=1/C22H22ClF3N8O2/c1-22(2,36)17(24)9-29-21(35)15-8-27-19(34-20-12(5-31-34)3-13(23)6-28-20)4-16(15)32-14-7-30-33(10-14)11-18(25)26/h3-8,10,17-18,36H,9,11H2,1-2H3,(H,27,32)(H,29,35)/t17-/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))
BDBM187810
PNG
(US9169252, 353)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1Nc1cnn(CC(F)(F)F)c1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C23H21F4N9O2/c1-22(2,38)18(24)10-31-21(37)16-9-29-19(36-20-14(7-33-36)3-13(5-28)6-30-20)4-17(16)34-15-8-32-35(11-15)12-23(25,26)27/h3-4,6-9,11,18,38H,10,12H2,1-2H3,(H,29,34)(H,31,37)/t18-/s2
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n/an/a 1.70n/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))
BDBM187811
PNG
(US9169252, 354)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1Nc1cnn(CC(F)(F)F)c1)-n1ncc2cc(Cl)cnc12
Show InChI InChI=1/C22H21ClF4N8O2/c1-21(2,37)17(24)9-30-20(36)15-8-28-18(35-19-12(5-32-35)3-13(23)6-29-19)4-16(15)33-14-7-31-34(10-14)11-22(25,26)27/h3-8,10,17,37H,9,11H2,1-2H3,(H,28,33)(H,30,36)/t17-/s2
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n/an/a 1.90n/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))
BDBM187812
PNG
(US9169252, 355)
Show SMILES CCn1cc(Nc2cc(ncc2C(=O)NC[C@@H](F)C(C)(C)O)-n2ncc3cc(cnc23)C#N)cn1
Show InChI InChI=1/C23H24FN9O2/c1-4-32-13-16(10-29-32)31-18-6-20(33-21-15(9-30-33)5-14(7-25)8-27-21)26-11-17(18)22(34)28-12-19(24)23(2,3)35/h5-6,8-11,13,19,35H,4,12H2,1-3H3,(H,26,31)(H,28,34)/t19-/s2
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n/an/a 2.40n/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))
BDBM187833
PNG
(US9169252, 376)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1Nc1cnn(CCC#N)c1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C24H23FN10O2/c1-24(2,37)20(25)13-30-23(36)18-12-28-21(35-22-16(10-32-35)6-15(8-27)9-29-22)7-19(18)33-17-11-31-34(14-17)5-3-4-26/h6-7,9-12,14,20,37H,3,5,13H2,1-2H3,(H,28,33)(H,30,36)/t20-/s2
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n/an/a 2.10n/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))
BDBM187837
PNG
(US9169252, 380)
Show SMILES CCCn1cc(Nc2cc(ncc2C(=O)NC[C@@H](F)C(C)(C)O)-n2ncc3cc(cnc23)C#N)cn1
Show InChI InChI=1/C24H26FN9O2/c1-4-5-33-14-17(11-30-33)32-19-7-21(34-22-16(10-31-34)6-15(8-26)9-28-22)27-12-18(19)23(35)29-13-20(25)24(2,3)36/h6-7,9-12,14,20,36H,4-5,13H2,1-3H3,(H,27,32)(H,29,35)/t20-/s2
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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
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM187846
PNG
(US9169252, 389)
Show SMILES CCCNC(=O)c1cnc(cc1Nc1cnn(CC(F)F)c1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1S/C21H19F2N9O/c1-2-3-25-21(33)16-10-26-19(32-20-14(8-29-32)4-13(6-24)7-27-20)5-17(16)30-15-9-28-31(11-15)12-18(22)23/h4-5,7-11,18H,2-3,12H2,1H3,(H,25,33)(H,26,30)
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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))
BDBM187847
PNG
(US9169252, 390)
Show SMILES CC(C)(C)NC(=O)c1cnc(cc1Nc1cnn(CC(F)F)c1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1S/C22H21F2N9O/c1-22(2,3)31-21(34)16-10-26-19(33-20-14(8-29-33)4-13(6-25)7-27-20)5-17(16)30-15-9-28-32(11-15)12-18(23)24/h4-5,7-11,18H,12H2,1-3H3,(H,26,30)(H,31,34)
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n/an/a 17n/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))
BDBM187848
PNG
(US9169252, 391)
Show SMILES CC(C)CNC(=O)c1cnc(cc1Nc1cnn(CC(F)F)c1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1S/C22H21F2N9O/c1-13(2)6-28-22(34)17-10-26-20(33-21-15(8-30-33)3-14(5-25)7-27-21)4-18(17)31-16-9-29-32(11-16)12-19(23)24/h3-4,7-11,13,19H,6,12H2,1-2H3,(H,26,31)(H,28,34)
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n/an/a 6.20n/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))
BDBM187849
PNG
(US9169252, 392)
Show SMILES CCOCCNC(=O)c1cnc(cc1Nc1cnn(CC(F)F)c1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1S/C22H21F2N9O2/c1-2-35-4-3-26-22(34)17-11-27-20(33-21-15(9-30-33)5-14(7-25)8-28-21)6-18(17)31-16-10-29-32(12-16)13-19(23)24/h5-6,8-12,19H,2-4,13H2,1H3,(H,26,34)(H,27,31)
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n/an/a 7.10n/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))
BDBM187850
PNG
(US9169252, 393)
Show SMILES CCNC(=O)c1cnc(cc1Nc1cnn(CC(F)F)c1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1S/C20H17F2N9O/c1-2-24-20(32)15-9-25-18(31-19-13(7-28-31)3-12(5-23)6-26-19)4-16(15)29-14-8-27-30(10-14)11-17(21)22/h3-4,6-10,17H,2,11H2,1H3,(H,24,32)(H,25,29)
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n/an/a 3.5n/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))
BDBM187806
PNG
(US9169252, 349)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1Nc1cnn(c1)C1CCOCC1)-n1ncc2cc(cnc12)C#N
Show InChI InChI=1/C26H28FN9O3/c1-26(2,38)22(27)14-31-25(37)20-13-29-23(36-24-17(11-33-36)7-16(9-28)10-30-24)8-21(20)34-18-12-32-35(15-18)19-3-5-39-6-4-19/h7-8,10-13,15,19,22,38H,3-6,14H2,1-2H3,(H,29,34)(H,31,37)/t22-/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