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Compile Data Set for Download or QSAR

Found 6616 hits Enz. Inhib. hit(s) with Target = 'Toll-like receptor 7'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427894
PNG
(US10544143, Example 328 | US10544143, Example 329 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(CC1)NC1CCOC1
PDB

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n/an/a 0.0800n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427894
PNG
(US10544143, Example 328 | US10544143, Example 329 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(CC1)NC1CCOC1
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n/an/a 0.0800n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM428633
PNG
(US10544143, Example 1069 | US10544143, Example 107...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(nc2c1C(C)C)C1CCC(CC1)N1CC2(C1)CCOC2
Show InChI InChI=1S/C29H36N6O2/c1-18(2)25-26(20-12-24(36-3)28-30-17-31-35(28)13-20)33-23-9-8-22(32-27(23)25)19-4-6-21(7-5-19)34-14-29(15-34)10-11-37-16-29/h8-9,12-13,17-19,21,33H,4-7,10-11,14-16H2,1-3H3
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n/an/a 0.0900n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM428633
PNG
(US10544143, Example 1069 | US10544143, Example 107...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(nc2c1C(C)C)C1CCC(CC1)N1CC2(C1)CCOC2
Show InChI InChI=1S/C29H36N6O2/c1-18(2)25-26(20-12-24(36-3)28-30-17-31-35(28)13-20)33-23-9-8-22(32-27(23)25)19-4-6-21(7-5-19)34-14-29(15-34)10-11-37-16-29/h8-9,12-13,17-19,21,33H,4-7,10-11,14-16H2,1-3H3
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n/an/a 0.0900n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273647
PNG
(US10071079, Example 432 | US10478424, Example 432)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC1)C(CCO)CCO)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C28H37N5O2/c1-18(2)26-24-15-21(20-6-10-32(11-7-20)23(8-12-34)9-13-35)4-5-25(24)31-27(26)22-14-19(3)28-29-17-30-33(28)16-22/h4-5,14-18,20,23,31,34-35H,6-13H2,1-3H3
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n/an/a 0.100n/an/an/an/an/a25



Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273647
PNG
(US10071079, Example 432 | US10478424, Example 432)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC1)C(CCO)CCO)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C28H37N5O2/c1-18(2)26-24-15-21(20-6-10-32(11-7-20)23(8-12-34)9-13-35)4-5-25(24)31-27(26)22-14-19(3)28-29-17-30-33(28)16-22/h4-5,14-18,20,23,31,34-35H,6-13H2,1-3H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427907
PNG
(US10544143, Example 341 | US10544143, Example 342 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(F)c(nc2c1C(C)C)C1CCC(CC1)NCC1(C)COC1
Show InChI InChI=1S/C28H35FN6O2/c1-16(2)23-25(18-9-22(36-4)27-31-15-32-35(27)11-18)33-21-10-20(29)24(34-26(21)23)17-5-7-19(8-6-17)30-12-28(3)13-37-14-28/h9-11,15-17,19,30,33H,5-8,12-14H2,1-4H3
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n/an/a 0.120n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427907
PNG
(US10544143, Example 341 | US10544143, Example 342 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(F)c(nc2c1C(C)C)C1CCC(CC1)NCC1(C)COC1
Show InChI InChI=1S/C28H35FN6O2/c1-16(2)23-25(18-9-22(36-4)27-31-15-32-35(27)11-18)33-21-10-20(29)24(34-26(21)23)17-5-7-19(8-6-17)30-12-28(3)13-37-14-28/h9-11,15-17,19,30,33H,5-8,12-14H2,1-4H3
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n/an/a 0.120n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427891
PNG
(US10544143, Example 325 | US10544143, Example 326 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(CC1)N1CCC1
Show InChI InChI=1S/C27H34N6O/c1-16(2)23-25(19-13-22(34-4)27-28-15-29-33(27)14-19)30-21-12-17(3)24(31-26(21)23)18-6-8-20(9-7-18)32-10-5-11-32/h12-16,18,20,30H,5-11H2,1-4H3
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n/an/a 0.130n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427891
PNG
(US10544143, Example 325 | US10544143, Example 326 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(CC1)N1CCC1
Show InChI InChI=1S/C27H34N6O/c1-16(2)23-25(19-13-22(34-4)27-28-15-29-33(27)14-19)30-21-12-17(3)24(31-26(21)23)18-6-8-20(9-7-18)32-10-5-11-32/h12-16,18,20,30H,5-11H2,1-4H3
PDB

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n/an/a 0.130n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427896
PNG
(US10544143, Example 330 | US10544143, Example 331 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(CC1)N(C)C1COC1
Show InChI InChI=1S/C28H36N6O2/c1-16(2)24-26(19-11-23(35-5)28-29-15-30-34(28)12-19)31-22-10-17(3)25(32-27(22)24)18-6-8-20(9-7-18)33(4)21-13-36-14-21/h10-12,15-16,18,20-21,31H,6-9,13-14H2,1-5H3
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n/an/a 0.140n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427896
PNG
(US10544143, Example 330 | US10544143, Example 331 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(CC1)N(C)C1COC1
Show InChI InChI=1S/C28H36N6O2/c1-16(2)24-26(19-11-23(35-5)28-29-15-30-34(28)12-19)31-22-10-17(3)25(32-27(22)24)18-6-8-20(9-7-18)33(4)21-13-36-14-21/h10-12,15-16,18,20-21,31H,6-9,13-14H2,1-5H3
PDB

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n/an/a 0.140n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427762
PNG
(US10544143, Example 195 | US10544143, Example 199)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(nc2c1C(C)C)C1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C27H34N6O/c1-17(2)24-25(19-14-23(34-3)27-28-16-29-33(27)15-19)31-22-11-10-21(30-26(22)24)18-6-8-20(9-7-18)32-12-4-5-13-32/h10-11,14-18,20,31H,4-9,12-13H2,1-3H3
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n/an/a 0.160n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427741
PNG
(US10544143, Example 174 | US10730877, Example 199)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(nc2c1C(C)C)C1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C27H34N6O/c1-17(2)24-25(19-14-23(34-3)27-28-16-29-33(27)15-19)31-22-11-10-21(30-26(22)24)18-6-8-20(9-7-18)32-12-4-5-13-32/h10-11,14-18,20,31H,4-9,12-13H2,1-3H3
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n/an/a 0.160n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM428604
PNG
(US10544143, Example 1040 | US10544143, Example 105...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)C1CCC(CC1)N1CC(C)(C)C1)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C29H38N6/c1-17(2)25-26(22-13-35-28(30-16-31-35)19(4)18(22)3)33-24-12-11-23(32-27(24)25)20-7-9-21(10-8-20)34-14-29(5,6)15-34/h11-13,16-17,20-21,33H,7-10,14-15H2,1-6H3
PDB

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n/an/a 0.170n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM428604
PNG
(US10544143, Example 1040 | US10544143, Example 105...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)C1CCC(CC1)N1CC(C)(C)C1)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C29H38N6/c1-17(2)25-26(22-13-35-28(30-16-31-35)19(4)18(22)3)33-24-12-11-23(32-27(24)25)20-7-9-21(10-8-20)34-14-29(5,6)15-34/h11-13,16-17,20-21,33H,7-10,14-15H2,1-6H3
PDB

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n/an/a 0.170n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427884
PNG
(US10544143, Example 318 | US10544143, Example 323 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(N)CC1
Show InChI InChI=1S/C24H30N6O/c1-13(2)20-22(16-10-19(31-4)24-26-12-27-30(24)11-16)28-18-9-14(3)21(29-23(18)20)15-5-7-17(25)8-6-15/h9-13,15,17,28H,5-8,25H2,1-4H3
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n/an/a 0.170n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427884
PNG
(US10544143, Example 318 | US10544143, Example 323 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(N)CC1
Show InChI InChI=1S/C24H30N6O/c1-13(2)20-22(16-10-19(31-4)24-26-12-27-30(24)11-16)28-18-9-14(3)21(29-23(18)20)15-5-7-17(25)8-6-15/h9-13,15,17,28H,5-8,25H2,1-4H3
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n/an/a 0.170n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM428090
PNG
(US10544143, Example 525 | US10730877, Example 525)
Show SMILES CC(C)c1c([nH]c2cc(C)c(nc12)C1CCNCC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C23H28N6/c1-13(2)19-21(17-9-15(4)23-25-12-26-29(23)11-17)27-18-10-14(3)20(28-22(18)19)16-5-7-24-8-6-16/h9-13,16,24,27H,5-8H2,1-4H3
PDB

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n/an/a 0.180n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM428090
PNG
(US10544143, Example 525 | US10730877, Example 525)
Show SMILES CC(C)c1c([nH]c2cc(C)c(nc12)C1CCNCC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C23H28N6/c1-13(2)19-21(17-9-15(4)23-25-12-26-29(23)11-17)27-18-10-14(3)20(28-22(18)19)16-5-7-24-8-6-16/h9-13,16,24,27H,5-8H2,1-4H3
PDB

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n/an/a 0.180n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM428372
PNG
(US10544143, Example 808 | US10544143, Example 838 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCN(C[C@H]1C)C(=O)CN(C)C)-c1cn2ncnc2c(C)c1C
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM428372
PNG
(US10544143, Example 808 | US10544143, Example 838 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCN(C[C@H]1C)C(=O)CN(C)C)-c1cn2ncnc2c(C)c1C
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427909
PNG
(US10544143, Example 343 | US10544143, Example 344 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(F)c(nc2c1C(C)C)C1CCC(CC1)N1CC2(COC2)C1
Show InChI InChI=1S/C28H33FN6O2/c1-16(2)23-25(18-8-22(36-3)27-30-15-31-35(27)10-18)32-21-9-20(29)24(33-26(21)23)17-4-6-19(7-5-17)34-11-28(12-34)13-37-14-28/h8-10,15-17,19,32H,4-7,11-14H2,1-3H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10544143 (2020)


BindingDB Entry DOI: 10.7270/Q2QF8W80
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427909
PNG
(US10544143, Example 343 | US10544143, Example 344 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(F)c(nc2c1C(C)C)C1CCC(CC1)N1CC2(COC2)C1
Show InChI InChI=1S/C28H33FN6O2/c1-16(2)23-25(18-8-22(36-3)27-30-15-31-35(27)10-18)32-21-9-20(29)24(33-26(21)23)17-4-6-19(7-5-17)34-11-28(12-34)13-37-14-28/h8-10,15-17,19,32H,4-7,11-14H2,1-3H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM427905
PNG
(US10544143, Example 339 | US10544143, Example 340 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(CC1)N(C)CCC#N
Show InChI InChI=1S/C28H35N7O/c1-17(2)24-26(20-14-23(36-5)28-30-16-31-35(28)15-20)32-22-13-18(3)25(33-27(22)24)19-7-9-21(10-8-19)34(4)12-6-11-29/h13-17,19,21,32H,6-10,12H2,1-5H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10730877 (2020)

More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM274079
PNG
(US10071079, Example 865 | US10478424, Example 865)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(cc2c1C(C)C)C1CCN(CC(=O)N2CC(F)(F)C2)CC1
Show InChI InChI=1S/C28H32F2N6O2/c1-17(2)25-21-10-19(18-6-8-34(9-7-18)13-24(37)35-14-28(29,30)15-35)4-5-22(21)33-26(25)20-11-23(38-3)27-31-16-32-36(27)12-20/h4-5,10-12,16-18,33H,6-9,13-15H2,1-3H3
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM274079
PNG
(US10071079, Example 865 | US10478424, Example 865)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(cc2c1C(C)C)C1CCN(CC(=O)N2CC(F)(F)C2)CC1
Show InChI InChI=1S/C28H32F2N6O2/c1-17(2)25-21-10-19(18-6-8-34(9-7-18)13-24(37)35-14-28(29,30)15-35)4-5-22(21)33-26(25)20-11-23(38-3)27-31-16-32-36(27)12-20/h4-5,10-12,16-18,33H,6-9,13-15H2,1-3H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273981
PNG
(US10071079, Example 767 | US10478424, Example 767)
Show SMILES CC(C)N(C)CC(=O)N1CCC(CC1)c1ccc2[nH]c(c(C(C)C)c2c1)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C30H40N6O/c1-18(2)28-24-14-23(22-10-12-35(13-11-22)27(37)16-34(7)19(3)4)8-9-26(24)33-29(28)25-15-36-30(31-17-32-36)21(6)20(25)5/h8-9,14-15,17-19,22,33H,10-13,16H2,1-7H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273316
PNG
(US10071079, Example 90 | US10478424, Example 90)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC(=O)N2CCCC2)CC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C29H36N6O/c1-19(2)27-24-15-22(21-8-12-33(13-9-21)17-26(36)34-10-4-5-11-34)6-7-25(24)32-28(27)23-14-20(3)29-30-18-31-35(29)16-23/h6-7,14-16,18-19,21,32H,4-5,8-13,17H2,1-3H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273340
PNG
(US10071079, Example 119 | US10478424, Example 119)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCNCC1)-c1cn2ncnc2c(Cl)c1C
Show InChI InChI=1S/C23H26ClN5/c1-13(2)20-17-10-16(15-6-8-25-9-7-15)4-5-19(17)28-22(20)18-11-29-23(26-12-27-29)21(24)14(18)3/h4-5,10-13,15,25,28H,6-9H2,1-3H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273856
PNG
(US10071079, Example 642 | US10478424, Example 642)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC1)C(=O)CN(C)C)-c1cc(c2ncnn2c1)C(F)(F)F
Show InChI InChI=1S/C27H31F3N6O/c1-16(2)24-20-11-18(17-7-9-35(10-8-17)23(37)14-34(3)4)5-6-22(20)33-25(24)19-12-21(27(28,29)30)26-31-15-32-36(26)13-19/h5-6,11-13,15-17,33H,7-10,14H2,1-4H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273536
PNG
(US10071079, Example 319 | US10478424, Example 319)
Show SMILES CNC(=O)CN1CCC(CC1)c1ccc2[nH]c(c(C(C)C)c2c1)-c1cc(C2CC2)c2ncnn2c1
Show InChI InChI=1S/C28H34N6O/c1-17(2)26-23-12-20(18-8-10-33(11-9-18)15-25(35)29-3)6-7-24(23)32-27(26)21-13-22(19-4-5-19)28-30-16-31-34(28)14-21/h6-7,12-14,16-19,32H,4-5,8-11,15H2,1-3H3,(H,29,35)
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273910
PNG
(US10071079, Example 696 | US10478424, Example 696)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC1)C(=O)CN(C)C)-c1cc(C2CC2)c2ncnn2c1
Show InChI InChI=1S/C29H36N6O/c1-18(2)27-24-13-21(19-9-11-34(12-10-19)26(36)16-33(3)4)7-8-25(24)32-28(27)22-14-23(20-5-6-20)29-30-17-31-35(29)15-22/h7-8,13-15,17-20,32H,5-6,9-12,16H2,1-4H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273911
PNG
(US10071079, Example 697 | US10478424, Example 697)
Show SMILES CNCC(=O)N1CCC(CC1)c1ccc2[nH]c(c(C(C)C)c2c1)-c1cc(C2CC2)c2ncnn2c1
Show InChI InChI=1S/C28H34N6O/c1-17(2)26-23-12-20(18-8-10-33(11-9-18)25(35)14-29-3)6-7-24(23)32-27(26)21-13-22(19-4-5-19)28-30-16-31-34(28)15-21/h6-7,12-13,15-19,29,32H,4-5,8-11,14H2,1-3H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273929
PNG
(US10071079, Example 715 | US10478424, Example 715)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC1)C(=O)CN(CCO)C1CC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C30H38N6O2/c1-19(2)28-25-15-22(21-8-10-34(11-9-21)27(38)17-35(12-13-37)24-5-6-24)4-7-26(25)33-29(28)23-14-20(3)30-31-18-32-36(30)16-23/h4,7,14-16,18-19,21,24,33,37H,5-6,8-13,17H2,1-3H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273606
PNG
(US10071079, Example 391 | US10478424, Example 391)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CCCO)CC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C26H33N5O/c1-17(2)24-22-14-20(19-7-10-30(11-8-19)9-4-12-32)5-6-23(22)29-25(24)21-13-18(3)26-27-16-28-31(26)15-21/h5-6,13-17,19,29,32H,4,7-12H2,1-3H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM274105
PNG
(US10071079, Example 891 | US10478424, Example 891)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC1)C(=O)CCNCC(N)=O)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C29H37N7O2/c1-17(2)27-22-13-21(20-8-11-35(12-9-20)26(38)7-10-31-14-25(30)37)5-6-24(22)34-28(27)23-15-36-29(32-16-33-36)19(4)18(23)3/h5-6,13,15-17,20,31,34H,7-12,14H2,1-4H3,(H2,30,37)
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM273463
PNG
(US10071079, Example 246 | US10478424, Example 246)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC(C)(C)O)CC1)-c1cc(C)c2nc(C)nn2c1
Show InChI InChI=1S/C28H37N5O/c1-17(2)25-23-14-21(20-9-11-32(12-10-20)16-28(5,6)34)7-8-24(23)30-26(25)22-13-18(3)27-29-19(4)31-33(27)15-22/h7-8,13-15,17,20,30,34H,9-12,16H2,1-6H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
TLR7 and TLR8


(Homo sapiens (Human))
BDBM420564
PNG
(US10478424, Example 253)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC#N)CC1)-c1cc(c2ncnn2c1)C(F)(F)F
Show InChI InChI=1S/C25H25F3N6/c1-15(2)22-19-11-17(16-5-8-33(9-6-16)10-7-29)3-4-21(19)32-23(22)18-12-20(25(26,27)28)24-30-14-31-34(24)13-18/h3-4,11-16,32H,5-6,8-10H2,1-2H3
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Bristol-Myers Squibb Company

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10478424 (2019)


BindingDB Entry DOI: 10.7270/Q2QZ2DB0
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273910
PNG
(US10071079, Example 696 | US10478424, Example 696)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC1)C(=O)CN(C)C)-c1cc(C2CC2)c2ncnn2c1
Show InChI InChI=1S/C29H36N6O/c1-18(2)27-24-13-21(19-9-11-34(12-10-19)26(36)16-33(3)4)7-8-25(24)32-28(27)22-14-23(20-5-6-20)29-30-17-31-35(29)15-22/h7-8,13-15,17-20,32H,5-6,9-12,16H2,1-4H3
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273911
PNG
(US10071079, Example 697 | US10478424, Example 697)
Show SMILES CNCC(=O)N1CCC(CC1)c1ccc2[nH]c(c(C(C)C)c2c1)-c1cc(C2CC2)c2ncnn2c1
Show InChI InChI=1S/C28H34N6O/c1-17(2)26-23-12-20(18-8-10-33(11-9-18)25(35)14-29-3)6-7-24(23)32-27(26)21-13-22(19-4-5-19)28-30-16-31-34(28)15-21/h6-7,12-13,15-19,29,32H,4-5,8-11,14H2,1-3H3
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273606
PNG
(US10071079, Example 391 | US10478424, Example 391)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CCCO)CC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C26H33N5O/c1-17(2)24-22-14-20(19-7-10-30(11-8-19)9-4-12-32)5-6-23(22)29-25(24)21-13-18(3)26-27-16-28-31(26)15-21/h5-6,13-17,19,29,32H,4,7-12H2,1-3H3
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n/an/a 0.200n/an/an/an/an/a25



Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273929
PNG
(US10071079, Example 715 | US10478424, Example 715)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC1)C(=O)CN(CCO)C1CC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C30H38N6O2/c1-19(2)28-25-15-22(21-8-10-34(11-9-21)27(38)17-35(12-13-37)24-5-6-24)4-7-26(25)33-29(28)23-14-20(3)30-31-18-32-36(30)16-23/h4,7,14-16,18-19,21,24,33,37H,5-6,8-13,17H2,1-3H3
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273316
PNG
(US10071079, Example 90 | US10478424, Example 90)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC(=O)N2CCCC2)CC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C29H36N6O/c1-19(2)27-24-15-22(21-8-12-33(13-9-21)17-26(36)34-10-4-5-11-34)6-7-25(24)32-28(27)23-14-20(3)29-30-18-31-35(29)16-23/h6-7,14-16,18-19,21,32H,4-5,8-13,17H2,1-3H3
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273463
PNG
(US10071079, Example 246 | US10478424, Example 246)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC(C)(C)O)CC1)-c1cc(C)c2nc(C)nn2c1
Show InChI InChI=1S/C28H37N5O/c1-17(2)25-23-14-21(20-9-11-32(12-10-20)16-28(5,6)34)7-8-24(23)30-26(25)22-13-18(3)27-29-19(4)31-33(27)15-22/h7-8,13-15,17,20,30,34H,9-12,16H2,1-6H3
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM274105
PNG
(US10071079, Example 891 | US10478424, Example 891)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC1)C(=O)CCNCC(N)=O)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C29H37N7O2/c1-17(2)27-22-13-21(20-8-11-35(12-9-20)26(38)7-10-31-14-25(30)37)5-6-24(22)34-28(27)23-15-36-29(32-16-33-36)19(4)18(23)3/h5-6,13,15-17,20,31,34H,7-12,14H2,1-4H3,(H2,30,37)
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273470
PNG
(US10071079, Example 253 | US10071079, Example 263 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(cc2c1C(C)C)C1CCN(CCS(C)(=O)=O)CC1
Show InChI InChI=1S/C26H33N5O3S/c1-17(2)24-21-13-19(18-7-9-30(10-8-18)11-12-35(4,32)33)5-6-22(21)29-25(24)20-14-23(34-3)26-27-16-28-31(26)15-20/h5-6,13-18,29H,7-12H2,1-4H3
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273536
PNG
(US10071079, Example 319 | US10478424, Example 319)
Show SMILES CNC(=O)CN1CCC(CC1)c1ccc2[nH]c(c(C(C)C)c2c1)-c1cc(C2CC2)c2ncnn2c1
Show InChI InChI=1S/C28H34N6O/c1-17(2)26-23-12-20(18-8-10-33(11-9-18)15-25(35)29-3)6-7-24(23)32-27(26)21-13-22(19-4-5-19)28-30-16-31-34(28)14-21/h6-7,12-14,16-19,32H,4-5,8-11,15H2,1-3H3,(H,29,35)
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273856
PNG
(US10071079, Example 642 | US10478424, Example 642)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCN(CC1)C(=O)CN(C)C)-c1cc(c2ncnn2c1)C(F)(F)F
Show InChI InChI=1S/C27H31F3N6O/c1-16(2)24-20-11-18(17-7-9-35(10-8-17)23(37)14-34(3)4)5-6-22(20)33-25(24)19-12-21(27(28,29)30)26-31-15-32-36(26)13-19/h5-6,11-13,15-17,33H,7-10,14H2,1-4H3
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM273340
PNG
(US10071079, Example 119 | US10478424, Example 119)
Show SMILES CC(C)c1c([nH]c2ccc(cc12)C1CCNCC1)-c1cn2ncnc2c(Cl)c1C
Show InChI InChI=1S/C23H26ClN5/c1-13(2)20-17-10-16(15-6-8-25-9-7-15)4-5-19(17)28-22(20)18-11-29-23(26-12-27-29)21(24)14(18)3/h4-5,10-13,15,25,28H,6-9H2,1-3H3
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Bristol-Myers Squibb Co.

US Patent


Assay Description
HEK-Blue-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducible...


US Patent US10071079 (2018)


BindingDB Entry DOI: 10.7270/Q2VD71GV
More data for this
Ligand-Target Pair
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