Compile Data Set for Download or QSAR
Found 3210 Enz. Inhib. hit(s) with all data for assayid = 1 entry = 10139
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM516908(US11053244, Example 328 | US11053244, Example 329)
Show SMILES COc1cc(c[nH]\c1=N/C=N)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(CC1)NC1CCOC1
Show InChI InChI=1S/C28H36N6O2/c1-16(2)24-26(19-12-23(35-4)28(30-13-19)31-15-29)33-22-11-17(3)25(34-27(22)24)18-5-7-20(8-6-18)32-21-9-10-36-14-21/h11-13,15-16,18,20-21,29,32H,5-10,14H2,1-4H3/b26-19-,29-15?,31-28-
Affinity DataIC50: 0.0800nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428633(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
Affinity DataIC50: 0.0900nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427907(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
Affinity DataIC50: 0.120nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428533(US10544143, Example 969 | US10730877, Example 969 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCN(CC1)C(=O)CN(C)CCO)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C27H36N8O2/c1-17(2)24-25(20-14-35-27(28-16-29-35)19(4)18(20)3)30-21-6-7-22(31-26(21)24)33-8-10-34(11-9-33)23(37)15-32(5)12-13-36/h6-7,14,16-17,30,36H,8-13,15H2,1-5H3
Affinity DataIC50: 0.120nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428547(US10544143, Example 983 | US10730877, Example 983 ...)
Show SMILES CC(C)[C@H]1CN(CCN1)c1ccc2[nH]c(c(C(C)C)c2n1)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.120nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427891(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
Affinity DataIC50: 0.130nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427896(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
Affinity DataIC50: 0.140nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427673(1-(4-(2-(7,8-dimethyl-[1,2,4]triazolo[1,5-a]pyridi...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCN(CC(C)(C)O)CC1)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C26H35N7O/c1-16(2)22-23(19-13-33-25(27-15-28-33)18(4)17(19)3)29-20-7-8-21(30-24(20)22)32-11-9-31(10-12-32)14-26(5,6)34/h7-8,13,15-16,29,34H,9-12,14H2,1-6H3
Affinity DataIC50: 0.150nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428465(US10544143, Example 901 | US10730877, Example 901 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCN(C[C@@H]1C)C(=O)CN1CC2(COC2)C1)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.150nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427741(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
Affinity DataIC50: 0.160nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428633(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
Affinity DataIC50: 0.170nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428448(US10544143, Example 884 | US10730877, Example 884 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1C[C@@H](C)N[C@H](C)C1)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.170nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428604(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
Affinity DataIC50: 0.170nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427884(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
Affinity DataIC50: 0.170nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428090(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
Affinity DataIC50: 0.180nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428372(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
Affinity DataIC50: 0.190nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427909(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
Affinity DataIC50: 0.190nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427905(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
Affinity DataIC50: 0.200nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427911(US10544143, Example 345 | US10544143, Example 346 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(F)c(nc2c1C(C)C)C1CCC(CC1)NC1COC1
Show InChI InChI=1S/C26H31FN6O2/c1-14(2)22-24(16-8-21(34-3)26-28-13-29-33(26)10-16)31-20-9-19(27)23(32-25(20)22)15-4-6-17(7-5-15)30-18-11-35-12-18/h8-10,13-15,17-18,30-31H,4-7,11-12H2,1-3H3
Affinity DataIC50: 0.210nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427879(US10544143, Example 313 | US10544143, Example 320 ...)
Show SMILES CCN(C)C1CCC(CC1)c1nc2c(C(C)C)c([nH]c2cc1C)-c1cc(OC)c2ncnn2c1
Show InChI InChI=1S/C27H36N6O/c1-7-32(5)20-10-8-18(9-11-20)24-17(4)12-21-26(31-24)23(16(2)3)25(30-21)19-13-22(34-6)27-28-15-29-33(27)14-19/h12-16,18,20,30H,7-11H2,1-6H3
Affinity DataIC50: 0.210nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428081(US10544143, Example 516 | US10730877, Example 516 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)C1CCNCC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C22H26N6/c1-13(2)19-20(16-10-14(3)22-24-12-25-28(22)11-16)27-18-5-4-17(26-21(18)19)15-6-8-23-9-7-15/h4-5,10-13,15,23,27H,6-9H2,1-3H3
Affinity DataIC50: 0.220nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428552(US10544143, Example 988 | US10730877, Example 988 ...)
Show SMILES CC[C@H]1CNCCN1c1ccc2[nH]c(c(C(C)C)c2n1)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.230nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427618(US10544143, Example 53 | US10730877, Example 53 | ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCC(CC1)NCCS(C)(=O)=O)-c1cn(C)c2ncccc12
Show InChI InChI=1S/C26H34N6O2S/c1-17(2)23-24(20-16-31(3)26-19(20)6-5-11-28-26)29-21-7-8-22(30-25(21)23)32-13-9-18(10-14-32)27-12-15-35(4,33)34/h5-8,11,16-18,27,29H,9-10,12-15H2,1-4H3
Affinity DataIC50: 0.230nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428386(US10544143, Example 822 | US10730877, Example 822 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCN[C@H](C)C1)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.240nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428148(US10544143, Example 584 | US10730877, Example 584 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCN(CC(=O)N(C)C)CC1
Show InChI InChI=1S/C27H35N7O2/c1-16(2)23-25(19-12-21(36-6)27-28-15-29-34(27)13-19)30-20-11-17(3)24(31-26(20)23)18-7-9-33(10-8-18)14-22(35)32(4)5/h11-13,15-16,18,30H,7-10,14H2,1-6H3
Affinity DataIC50: 0.240nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428153(US10544143, Example 589 | US10730877, Example 589 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCN(CC1)C1CCOCC1
Show InChI InChI=1S/C28H36N6O2/c1-17(2)24-26(20-14-23(35-4)28-29-16-30-34(28)15-20)31-22-13-18(3)25(32-27(22)24)19-5-9-33(10-6-19)21-7-11-36-12-8-21/h13-17,19,21,31H,5-12H2,1-4H3
Affinity DataIC50: 0.25nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428528(US10544143, Example 1034 | US10544143, Example 964...)
Show SMILES CNCCC(=O)N1C[C@H](C)N(C[C@H]1C)c1ccc2[nH]c(c(C(C)C)c2n1)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.25nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427669(US10544143, Example 101 | US10730877, Example 101 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCN(CC1)C1CCOCC1)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C27H35N7O/c1-17(2)24-25(21-15-34-27(28-16-29-34)19(4)18(21)3)30-22-5-6-23(31-26(22)24)33-11-9-32(10-12-33)20-7-13-35-14-8-20/h5-6,15-17,20,30H,7-14H2,1-4H3
Affinity DataIC50: 0.25nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427822(US10544143, Example 255 | US10544143, Example 256 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)C1CCC(CC1)N1CC2(C1)CS(=O)(=O)C2)-c1cn(C)c2ncccc12
Show InChI InChI=1S/C29H35N5O2S/c1-18(2)25-26(22-13-33(3)28-21(22)5-4-12-30-28)32-24-11-10-23(31-27(24)25)19-6-8-20(9-7-19)34-14-29(15-34)16-37(35,36)17-29/h4-5,10-13,18-20,32H,6-9,14-17H2,1-3H3
Affinity DataIC50: 0.25nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427878(US10544143, Example 312 | US10544143, Example 315 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(CC1)NCC1(C)COC1
Show InChI InChI=1S/C29H38N6O2/c1-17(2)24-26(20-11-23(36-5)28-31-16-32-35(28)12-20)33-22-10-18(3)25(34-27(22)24)19-6-8-21(9-7-19)30-13-29(4)14-37-15-29/h10-12,16-17,19,21,30,33H,6-9,13-15H2,1-5H3
Affinity DataIC50: 0.260nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427714(US10544143, Example 147 | US10730877, Example 147 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCN(CCCS(C)(=O)=O)CC1)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C26H35N7O2S/c1-17(2)23-24(20-15-33-26(27-16-28-33)19(4)18(20)3)29-21-7-8-22(30-25(21)23)32-12-10-31(11-13-32)9-6-14-36(5,34)35/h7-8,15-17,29H,6,9-14H2,1-5H3
Affinity DataIC50: 0.260nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428472(US10544143, Example 908 | US10730877, Example 908 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1C[C@@H](C)N(C[C@@H]1C)C(=O)CCN1CC2(COC2)C1)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.260nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427913(US10544143, Example 347 | US10544143, Example 348 ...)
Show SMILES CNC1CCC(CC1)c1nc2c(C(C)C)c([nH]c2cc1F)-c1cc(OC)c2ncnn2c1
Show InChI InChI=1S/C24H29FN6O/c1-13(2)20-22(15-9-19(32-4)24-27-12-28-31(24)11-15)29-18-10-17(25)21(30-23(18)20)14-5-7-16(26-3)8-6-14/h9-14,16,26,29H,5-8H2,1-4H3
Affinity DataIC50: 0.270nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428112(US10544143, Example 547 | US10730877, Example 547 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)C1CCN(CC(C)(C)O)CC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C26H34N6O/c1-16(2)22-23(19-12-17(3)25-27-15-28-32(25)13-19)30-21-7-6-20(29-24(21)22)18-8-10-31(11-9-18)14-26(4,5)33/h6-7,12-13,15-16,18,30,33H,8-11,14H2,1-5H3
Affinity DataIC50: 0.270nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427564(6-(3-isopropyl-5-(piperazin-1-yl)-1H-pyrrolo[3,2-b...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCNCC1)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C22H27N7/c1-13(2)19-20(16-11-29-22(24-12-25-29)15(4)14(16)3)26-17-5-6-18(27-21(17)19)28-9-7-23-8-10-28/h5-6,11-13,23,26H,7-10H2,1-4H3
Affinity DataIC50: 0.270nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428522(US10544143, Example 958 | US10730877, Example 958 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1C[C@@H](C)N(C[C@@H]1C)C(=O)CCN1CC2(CCO2)C1)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.270nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428555(US10544143, Example 991 | US10730877, Example 991 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1C[C@H](C)NC[C@@H]1C)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.270nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427754(US10544143, Example 187 | US10730877, Example 187 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(nc2c1C(C)C)C1CCC(CC1)N(C)C
Show InChI InChI=1S/C25H32N6O/c1-15(2)22-23(17-12-21(32-5)25-26-14-27-31(25)13-17)29-20-11-10-19(28-24(20)22)16-6-8-18(9-7-16)30(3)4/h10-16,18,29H,6-9H2,1-5H3
Affinity DataIC50: 0.280nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427663(6-(3-isopropyl-5-(4-methylpiperazin-1-yl)-1H-pyrro...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1CCN(C)CC1)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C23H29N7/c1-14(2)20-21(17-12-30-23(24-13-25-30)16(4)15(17)3)26-18-6-7-19(27-22(18)20)29-10-8-28(5)9-11-29/h6-7,12-14,26H,8-11H2,1-5H3
Affinity DataIC50: 0.280nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427674(US10544143, Example 106 | US10730877, Example 106 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2ccc(nc2c1C(C)C)N1CCN(CC(C)(C)O)CC1
Show InChI InChI=1S/C25H33N7O2/c1-16(2)21-22(17-12-19(34-5)24-26-15-27-32(24)13-17)28-18-6-7-20(29-23(18)21)31-10-8-30(9-11-31)14-25(3,4)33/h6-7,12-13,15-16,28,33H,8-11,14H2,1-5H3
Affinity DataIC50: 0.280nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427755(US10544143, Example 188 | US10544143, Example 189 ...)
Show SMILES CNC1CCC(CC1)c1ccc2[nH]c(c(C(C)C)c2n1)-c1cc(OC)c2ncnn2c1
Show InChI InChI=1S/C24H30N6O/c1-14(2)21-22(16-11-20(31-4)24-26-13-27-30(24)12-16)29-19-10-9-18(28-23(19)21)15-5-7-17(25-3)8-6-15/h9-15,17,25,29H,5-8H2,1-4H3
Affinity DataIC50: 0.290nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428523(US10544143, Example 959 | US10730877, Example 959 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1C[C@@H](C)N(C[C@@H]1C)C(=O)CCN1CC2(C1)CS(=O)(=O)C2)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.290nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428426(US10544143, Example 862 | US10730877, Example 862 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1C[C@H](C)N([C@H](C)C1)C(=O)CN(C)C)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.290nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428145(US10544143, Example 581 | US10730877, Example 581 ...)
Show SMILES CC(C)c1c([nH]c2cc(C)c(nc12)C1CCN(CC(=O)N(C)C)CC1)-c1cc(C)c2ncnn2c1
Show InChI InChI=1S/C27H35N7O/c1-16(2)23-25(20-11-18(4)27-28-15-29-34(27)13-20)30-21-12-17(3)24(31-26(21)23)19-7-9-33(10-8-19)14-22(35)32(5)6/h11-13,15-16,19,30H,7-10,14H2,1-6H3
Affinity DataIC50: 0.300nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 8(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428023(US10544143, Example 457 | US10544143, Example 458 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)C1CCC(CC1)N(CCS(C)(=O)=O)CC#N)-c1cn2ncnc2c(C)c1C
Show InChI InChI=1S/C29H37N7O2S/c1-18(2)26-27(23-16-36-29(31-17-32-36)20(4)19(23)3)34-25-11-10-24(33-28(25)26)21-6-8-22(9-7-21)35(13-12-30)14-15-39(5,37)38/h10-11,16-18,21-22,34H,6-9,13-15H2,1-5H3
Affinity DataIC50: 0.300nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427568(N-(2-(dimethylamino)ethyl)-N-ethyl-3-isopropyl-2-(...)
Show SMILES CCN(CCN(C)C)C(=O)c1nc2c(C(C)C)c([nH]c2cc1C)-c1cc(OC)c2ncnn2c1
Show InChI InChI=1S/C25H33N7O2/c1-8-31(10-9-30(5)6)25(33)21-16(4)11-18-23(29-21)20(15(2)3)22(28-18)17-12-19(34-7)24-26-14-27-32(24)13-17/h11-15,28H,8-10H2,1-7H3
Affinity DataIC50: 0.300nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428424(US10544143, Example 860 | US10730877, Example 860 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1C[C@H](C)N([C@H](C)C1)C(=O)CCN(C)C)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.300nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM427875(US10544143, Example 309 | US10544143, Example 316 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCC(CC1)NC1COC1
Show InChI InChI=1S/C27H34N6O2/c1-15(2)23-25(18-10-22(34-4)27-28-14-29-33(27)11-18)31-21-9-16(3)24(32-26(21)23)17-5-7-19(8-6-17)30-20-12-35-13-20/h9-11,14-15,17,19-20,30-31H,5-8,12-13H2,1-4H3
Affinity DataIC50: 0.310nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428151(US10544143, Example 587 | US10730877, Example 587 ...)
Show SMILES COc1cc(cn2ncnc12)-c1[nH]c2cc(C)c(nc2c1C(C)C)C1CCN(CC(C)(C)O)CC1
Show InChI InChI=1S/C27H36N6O2/c1-16(2)22-24(19-12-21(35-6)26-28-15-29-33(26)13-19)30-20-11-17(3)23(31-25(20)22)18-7-9-32(10-8-18)14-27(4,5)34/h11-13,15-16,18,30,34H,7-10,14H2,1-6H3
Affinity DataIC50: 0.310nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetToll-like receptor 7(Homo sapiens (Human))
Bristol-Myers Squibb Company

US Patent
LigandPNGBDBM428425(US10544143, Example 861 | US10730877, Example 861 ...)
Show SMILES CC(C)c1c([nH]c2ccc(nc12)N1[C@H](C)CNC[C@H]1C)-c1cn2ncnc2c(C)c1C
Affinity DataIC50: 0.310nMAssay Description:HEK-Blue™-cells (Invivogen) overexpressing human TLR7, TLR8 or TLR9 receptors were used for screening inhibitors of these receptors using an inducibl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
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