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36 similar compounds to monomer 187524

Compile data set for download or QSAR
Wt: 401.4
BDBM187612
Wt: 456.4
BDBM187471
Wt: 399.4
BDBM187473
Wt: 433.9
BDBM187475
Wt: 442.4
BDBM187477
Wt: 416.4
BDBM187613
Wt: 419.8
BDBM187432
Wt: 431.8
BDBM187433
Wt: 417.4
BDBM187437
Wt: 400.4
BDBM187438
Wt: 442.4
BDBM187439
Wt: 398.4
BDBM187440
Wt: 435.5
BDBM187484
Wt: 430.4
BDBM187441
Wt: 424.4
BDBM187442
Displayed 1 to 15 (of 36 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 187612,187471,187473,187475,187477,187613,187432,187433,187437,187438,187439,187440,187484,187441,187442   
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))
BDBM187432
PNG
(US9169252, 33)
Show SMILES CCNc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(Cl)cnc12
Show InChI InChI=1/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-/s2
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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))
BDBM187613
PNG
(US9169252, 171)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1cnc2cnc(N)nc12
Show InChI InChI=1/C19H25FN8O2/c1-10(2)26-12-5-15(28-9-25-13-7-24-18(21)27-16(13)28)22-6-11(12)17(29)23-8-14(20)19(3,4)30/h5-7,9-10,14,30H,8H2,1-4H3,(H,22,26)(H,23,29)(H2,21,24,27)/t14-/s2
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n/an/a 3.70n/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))
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=1/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-/s2
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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))
BDBM187438
PNG
(US9169252, 39)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cncnc12
Show InChI InChI=1/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-/s2
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n/an/a 1.10n/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))
BDBM187439
PNG
(US9169252, 40)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CCOCC1)-n1ccc2cncnc12
Show InChI InChI=1/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-/s2
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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=1/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-/s2
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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=1/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-/s2
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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))
BDBM187471
PNG
(US9169252, 72)
Show SMILES CC(F)[C@H](C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1/C23H26F2N6O2/c1-13(24)14(2)30-18-8-20(31-6-5-16-7-15(9-26)10-28-21(16)31)27-11-17(18)22(32)29-12-19(25)23(3,4)33/h5-8,10-11,13-14,19,33H,12H2,1-4H3,(H,27,30)(H,29,32)/t13?,14-,19+/s2
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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))
BDBM187473
PNG
(US9169252, 74)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cccnc12
Show InChI InChI=1/C21H26FN5O2/c1-13(2)26-16-10-18(27-9-7-14-6-5-8-23-19(14)27)24-11-15(16)20(28)25-12-17(22)21(3,4)29/h5-11,13,17,29H,12H2,1-4H3,(H,24,26)(H,25,28)/t17-/s2
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n/an/a 4.30n/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))
BDBM187475
PNG
(US9169252, 76)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(Cl)cnc12
Show InChI InChI=1/C21H25ClFN5O2/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-/s2
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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))
BDBM187477
PNG
(US9169252, 78)
Show SMILES CC(CF)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1/C22H24F2N6O2/c1-13(8-23)29-17-7-19(30-5-4-15-6-14(9-25)10-27-20(15)30)26-11-16(17)21(31)28-12-18(24)22(2,3)32/h4-7,10-11,13,18,32H,8,12H2,1-3H3,(H,26,29)(H,28,31)/t13?,18-/s2
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n/an/a 2.90n/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))
BDBM187484
PNG
(US9169252, 84)
Show SMILES CC(C)Nc1cc(ncc1C(=O)N[C@H]1CC[C@@H](CC1)NC(C)=O)-n1ccc2cncnc12
Show InChI InChI=1/C23H29N7O2/c1-14(2)27-20-10-21(30-9-8-16-11-24-13-26-22(16)30)25-12-19(20)23(32)29-18-6-4-17(5-7-18)28-15(3)31/h8-14,17-18H,4-7H2,1-3H3,(H,25,27)(H,28,31)(H,29,32)/t17-,18-
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n/an/a 9.30n/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))
BDBM187612
PNG
(US9169252, 170)
Show SMILES CC(C)Nc1cc(ncc1C(=O)NC[C@@H](F)C(C)(C)O)-n1cnc2cncnc12
Show InChI InChI=1/C19H24FN7O2/c1-11(2)26-13-5-16(27-10-25-14-7-21-9-24-17(14)27)22-6-12(13)18(28)23-8-15(20)19(3,4)29/h5-7,9-11,15,29H,8H2,1-4H3,(H,22,26)(H,23,28)/t15-/s2
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n/an/a 15.1n/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))
BDBM187433
PNG
(US9169252, 34)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1CC1)-n1ccc2cc(Cl)cnc12
Show InChI InChI=1/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-/s2
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n/an/a 5.30n/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