Compile Data Set for Download or QSAR
Found 63 of ec50 for UniProtKB: P08246
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM50120438(CHEMBL3617974 | US9290459, 23 | US9670166, 23)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(CC#N)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C24H17F3N4O4S/c1-36(34,35)20-11-14(13-29)5-6-17(20)22-21-18(7-8-19(21)32)31(23(33)30(22)10-9-28)16-4-2-3-15(12-16)24(25,26)27/h2-6,11-12,22H,7-8,10H2,1H3/t22-/m1/s1
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211884(US9290459, 45.5 | US9670166, 45.5)
Show SMILES O[C@H]1COC[C@@H]1NC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C26H21F3N4O5/c27-26(28,29)16-2-1-3-17(10-16)32-19-8-9-20(34)22(19)23(15-6-4-14(11-30)5-7-15)33(25(32)37)24(36)31-18-12-38-13-21(18)35/h1-7,10,18,21,23,35H,8-9,12-13H2,(H,31,36)/t18-,21-,23+/m0/s1
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211938(US9290459, 53.3 | US9670166, 53.3)
Show SMILES CS(=O)(=O)c1cc(ccc1C1N(C(=O)NC2CC2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)F)C#N
Show InChI InChI=1S/C26H22F2N4O5S/c1-38(36,37)21-11-14(13-29)5-8-18(21)23-22-19(9-10-20(22)33)31(17-4-2-3-15(12-17)24(27)28)26(35)32(23)25(34)30-16-6-7-16/h2-5,8,11-12,16,23-24H,6-7,9-10H2,1H3,(H,30,34)
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211939(US9290459, 53.4 | US9670166, 53.4)
Show SMILES CC(C)NC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C26H24F2N4O5S/c1-14(2)30-25(34)32-23(18-8-7-15(13-29)11-21(18)38(3,36)37)22-19(9-10-20(22)33)31(26(32)35)17-6-4-5-16(12-17)24(27)28/h4-8,11-12,14,23-24H,9-10H2,1-3H3,(H,30,34)
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211889(US9290459, 47.4 | US9670166, 47.4)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)NC2CC2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C26H21F3N4O5S/c1-39(37,38)21-11-14(13-30)5-8-18(21)23-22-19(9-10-20(22)34)32(17-4-2-3-15(12-17)26(27,28)29)25(36)33(23)24(35)31-16-6-7-16/h2-5,8,11-12,16,23H,6-7,9-10H2,1H3,(H,31,35)/t23-/m1/s1
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211890(US9290459, 47.5 | US9670166, 47.5)
Show SMILES CC(C)NC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C26H23F3N4O5S/c1-14(2)31-24(35)33-23(18-8-7-15(13-30)11-21(18)39(3,37)38)22-19(9-10-20(22)34)32(25(33)36)17-6-4-5-16(12-17)26(27,28)29/h4-8,11-12,14,23H,9-10H2,1-3H3,(H,31,35)/t23-/m1/s1
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211813(US9290459, 30A | US9475779, C.2A | US9670166, 30A)
Show SMILES CN1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)=O)C#N
Show InChI InChI=1S/C23H18F3N3O3S/c1-28-21(16-7-6-13(12-27)10-19(16)33(2)32)20-17(8-9-18(20)30)29(22(28)31)15-5-3-4-14(11-15)23(24,25)26/h3-7,10-11,21H,8-9H2,1-2H3/t21-,33?/m1/s1
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM50032890(CHEMBL3342780)
Show SMILES CS(=O)(=O)c1cc(ccc1C1N(C(=O)N2CC2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)F)C#N
Show InChI InChI=1S/C25H20F2N4O5S/c1-37(35,36)20-11-14(13-28)5-6-17(20)22-21-18(7-8-19(21)32)30(16-4-2-3-15(12-16)23(26)27)25(34)31(22)24(33)29-9-10-29/h2-6,11-12,22-23H,7-10H2,1H3
Affinity DataEC50: <1nMAssay Description:Inhibition of neutrophil elastase in human plasma using MeOSuc-Ala-Ala-Pro-Val-AMC as substrate by fluorescence assayMore data for this Ligand-Target Pair
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211750(US9290459, 7.2A | US9670166, 7.2A)
Show SMILES OCCNC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C24H19F3N4O4/c25-24(26,27)16-2-1-3-17(12-16)30-18-8-9-19(33)20(18)21(15-6-4-14(13-28)5-7-15)31(23(30)35)22(34)29-10-11-32/h1-7,12,21,32H,8-11H2,(H,29,34)/t21-/m1/s1
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoKEGGPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211763(US9290459, 14A | US9670166, 14A)
Show SMILES CCS(=O)(=O)c1cc(ccc1[C@H]1NC(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C23H18F3N3O4S/c1-2-34(32,33)19-10-13(12-27)6-7-16(19)21-20-17(8-9-18(20)30)29(22(31)28-21)15-5-3-4-14(11-15)23(24,25)26/h3-7,10-11,21H,2,8-9H2,1H3,(H,28,31)/t21-/m1/s1
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211931(US9290459, 52.1 | US9670166, 52.1)
Show SMILES CNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C23H18F2N4O3/c1-27-22(31)29-20(14-7-5-13(12-26)6-8-14)19-17(9-10-18(19)30)28(23(29)32)16-4-2-3-15(11-16)21(24)25/h2-8,11,20-21H,9-10H2,1H3,(H,27,31)
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211933(US9290459, 52.3 | US9670166, 52.3)
Show SMILES OCCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C24H20F2N4O4/c25-22(26)16-2-1-3-17(12-16)29-18-8-9-19(32)20(18)21(15-6-4-14(13-27)5-7-15)30(24(29)34)23(33)28-10-11-31/h1-7,12,21-22,31H,8-11H2,(H,28,33)
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoKEGGPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211812(US9290459, 29 | US9475779, D.1A)
Show SMILES CN1[C@@H](C2=C(CCC2=O)N(C1=O)c1ccnc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C22H17F3N4O4S/c1-28-20(14-4-3-12(11-26)9-17(14)34(2,32)33)19-15(5-6-16(19)30)29(21(28)31)13-7-8-27-18(10-13)22(23,24)25/h3-4,7-10,20H,5-6H2,1-2H3/t20-/m1/s1
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211838(US9290459, 41.1 | US9670166, 41.1)
Show SMILES C[C@H](O)CNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C25H21F3N4O4/c1-14(33)13-30-23(35)32-22(16-7-5-15(12-29)6-8-16)21-19(9-10-20(21)34)31(24(32)36)18-4-2-3-17(11-18)25(26,27)28/h2-8,11,14,22,33H,9-10,13H2,1H3,(H,30,35)/t14-,22?/m0/s1
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211786(US9290459, 22.4 | US9670166, 22.4)
Show SMILES CS(=O)(=O)c1cc(ccc1C1N(CC(=O)N2CC3CC3C2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C29H25F3N4O5S/c1-42(40,41)24-9-16(12-33)5-6-21(24)27-26-22(7-8-23(26)37)36(20-4-2-3-19(11-20)29(30,31)32)28(39)35(27)15-25(38)34-13-17-10-18(17)14-34/h2-6,9,11,17-18,27H,7-8,10,13-15H2,1H3
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211782(US9290459, 21 | US9670166, 21)
Show SMILES CN(CCO)C(=O)CN1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C27H25F3N4O6S/c1-32(10-11-35)23(37)15-33-25(19-7-6-16(14-31)12-22(19)41(2,39)40)24-20(8-9-21(24)36)34(26(33)38)18-5-3-4-17(13-18)27(28,29)30/h3-7,12-13,25,35H,8-11,15H2,1-2H3
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211932(US9290459, 52.2 | US9670166, 52.2)
Show SMILES CCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C24H20F2N4O3/c1-2-28-23(32)30-21(15-8-6-14(13-27)7-9-15)20-18(10-11-19(20)31)29(24(30)33)17-5-3-4-16(12-17)22(25)26/h3-9,12,21-22H,2,10-11H2,1H3,(H,28,32)
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211741(US9290459, 7.5 | US9670166, 7.5)
Show SMILES CN(C)CCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C26H24F3N5O3/c1-32(2)13-12-31-24(36)34-23(17-8-6-16(15-30)7-9-17)22-20(10-11-21(22)35)33(25(34)37)19-5-3-4-18(14-19)26(27,28)29/h3-9,14,23H,10-13H2,1-2H3,(H,31,36)
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211757(US9290459, 10A | US9290459, 47.21 | US9670166, 10A)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1NC(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C22H16F3N3O4S/c1-33(31,32)18-9-12(11-26)5-6-15(18)20-19-16(7-8-17(19)29)28(21(30)27-20)14-4-2-3-13(10-14)22(23,24)25/h2-6,9-10,20H,7-8H2,1H3,(H,27,30)/t20-/m1/s1
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211799(US9290459, 25 | US9670166, 25)
Show SMILES CN1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C23H18F3N3O4S/c1-28-21(16-7-6-13(12-27)10-19(16)34(2,32)33)20-17(8-9-18(20)30)29(22(28)31)15-5-3-4-14(11-15)23(24,25)26/h3-7,10-11,21H,8-9H2,1-2H3/t21-/m1/s1
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211887(US9290459, 47.2 | US9670166, 47.2)
Show SMILES CCNC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C25H21F3N4O5S/c1-3-30-23(34)32-22(17-8-7-14(13-29)11-20(17)38(2,36)37)21-18(9-10-19(21)33)31(24(32)35)16-6-4-5-15(12-16)25(26,27)28/h4-8,11-12,22H,3,9-10H2,1-2H3,(H,30,34)/t22-/m1/s1
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211742(US9290459, 7.6 | US9670166, 7.6)
Show SMILES CS(=O)CCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C25H21F3N4O4S/c1-37(36)12-11-30-23(34)32-22(16-7-5-15(14-29)6-8-16)21-19(9-10-20(21)33)31(24(32)35)18-4-2-3-17(13-18)25(26,27)28/h2-8,13,22H,9-12H2,1H3,(H,30,34)
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM50120439(CHEMBL3617975 | US9290459, 47.1 | US9670166, 47.1)
Show SMILES CNC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C24H19F3N4O5S/c1-29-22(33)31-21(16-7-6-13(12-28)10-19(16)37(2,35)36)20-17(8-9-18(20)32)30(23(31)34)15-5-3-4-14(11-15)24(25,26)27/h3-7,10-11,21H,8-9H2,1-2H3,(H,29,33)/t21-/m1/s1
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211935(US9290459, 52.5 | US9670166, 52.5)
Show SMILES CC(C)(O)CNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C26H24F2N4O4/c1-26(2,36)14-30-24(34)32-22(16-8-6-15(13-29)7-9-16)21-19(10-11-20(21)33)31(25(32)35)18-5-3-4-17(12-18)23(27)28/h3-9,12,22-23,36H,10-11,14H2,1-2H3,(H,30,34)
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211836(US9290459, 41A | US9670166, 41A)
Show SMILES CC(C)(O)CNC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C26H23F3N4O4/c1-25(2,37)14-31-23(35)33-22(16-8-6-15(13-30)7-9-16)21-19(10-11-20(21)34)32(24(33)36)18-5-3-4-17(12-18)26(27,28)29/h3-9,12,22,37H,10-11,14H2,1-2H3,(H,31,35)/t22-/m1/s1
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211886(US9290459, 46)
Show SMILES FC(F)(F)c1cccc(c1)N1C2=C([C@H](N(C(=O)NC3CCS(=N)(=O)CC3)C1=O)c1ccc(cc1)C#N)C(=O)CC2
Show InChI InChI=1S/C27H24F3N5O4S/c28-27(29,30)18-2-1-3-20(14-18)34-21-8-9-22(36)23(21)24(17-6-4-16(15-31)5-7-17)35(26(34)38)25(37)33-19-10-12-40(32,39)13-11-19/h1-7,14,19,24,32H,8-13H2,(H,33,37)/t19?,24-,40?/m1/s1
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211929(US9290459, 52A | US9670166, 52A)
Show SMILES OCCCNC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C25H22F2N4O4/c26-23(27)17-3-1-4-18(13-17)30-19-9-10-20(33)21(19)22(16-7-5-15(14-28)6-8-16)31(25(30)35)24(34)29-11-2-12-32/h1,3-8,13,22-23,32H,2,9-12H2,(H,29,34)/t22-/m1/s1
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211942(US9290459, 54.2 | US9670166, 54.2)
Show SMILES CCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1ccnc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C23H18F3N5O3/c1-2-28-21(33)31-20(14-5-3-13(12-27)4-6-14)19-16(7-8-17(19)32)30(22(31)34)15-9-10-29-18(11-15)23(24,25)26/h3-6,9-11,20H,2,7-8H2,1H3,(H,28,33)
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211822(US9290459, 33 | US9670166, 33)
Show SMILES COC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C24H18F3N3O6S/c1-36-23(33)30-21(16-7-6-13(12-28)10-19(16)37(2,34)35)20-17(8-9-18(20)31)29(22(30)32)15-5-3-4-14(11-15)24(25,26)27/h3-7,10-11,21H,8-9H2,1-2H3/t21-/m1/s1
Affinity DataEC50: <1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211875(US9290459, 42.6 | US9670166, 42.6)
Show SMILES O[C@@H]1COC[C@@H]1NC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C26H21F3N4O5/c27-26(28,29)16-2-1-3-17(10-16)32-19-8-9-20(34)22(19)23(15-6-4-14(11-30)5-7-15)33(25(32)37)24(36)31-18-12-38-13-21(18)35/h1-7,10,18,21,23,35H,8-9,12-13H2,(H,31,36)/t18-,21+,23?/m0/s1
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211745(US9290459, 7.9 | US9670166, 7.9)
Show SMILES CN1CC(CC1=O)NC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C27H22F3N5O4/c1-33-14-18(12-22(33)37)32-25(38)35-24(16-7-5-15(13-31)6-8-16)23-20(9-10-21(23)36)34(26(35)39)19-4-2-3-17(11-19)27(28,29)30/h2-8,11,18,24H,9-10,12,14H2,1H3,(H,32,38)
Affinity DataEC50:  1nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211883(US9290459, 45.4 | US9670166, 45.4)
Show SMILES O[C@H]1CCC[C@@H]1NC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C27H23F3N4O4/c28-27(29,30)17-3-1-4-18(13-17)33-20-11-12-22(36)23(20)24(16-9-7-15(14-31)8-10-16)34(26(33)38)25(37)32-19-5-2-6-21(19)35/h1,3-4,7-10,13,19,21,24,35H,2,5-6,11-12H2,(H,32,37)/t19-,21-,24+/m0/s1
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211748(US9290459, 7.1A | US9670166, 7.1A)
Show SMILES CNC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C23H17F3N4O3/c1-28-21(32)30-20(14-7-5-13(12-27)6-8-14)19-17(9-10-18(19)31)29(22(30)33)16-4-2-3-15(11-16)23(24,25)26/h2-8,11,20H,9-10H2,1H3,(H,28,32)/t20-/m1/s1
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211841(US9290459, 41.4 | US9670166, 41.4)
Show SMILES C[C@H](CO)NC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C25H21F3N4O4/c1-14(13-33)30-23(35)32-22(16-7-5-15(12-29)6-8-16)21-19(9-10-20(21)34)31(24(32)36)18-4-2-3-17(11-18)25(26,27)28/h2-8,11,14,22,33H,9-10,13H2,1H3,(H,30,35)/t14-,22?/m1/s1
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211853(US9290459, 41.16 | US9670166, 41.16)
Show SMILES FC(F)(F)c1cccc(c1)N1C2=C(C(N(C(=O)NC3CCOCC3)C1=O)c1ccc(cc1)C#N)C(=O)CC2
Show InChI InChI=1S/C27H23F3N4O4/c28-27(29,30)18-2-1-3-20(14-18)33-21-8-9-22(35)23(21)24(17-6-4-16(15-31)5-7-17)34(26(33)37)25(36)32-19-10-12-38-13-11-19/h1-7,14,19,24H,8-13H2,(H,32,36)
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211842(US9290459, 41.5 | US9670166, 41.5)
Show SMILES OCC1(CC1)NC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C26H21F3N4O4/c27-26(28,29)17-2-1-3-18(12-17)32-19-8-9-20(35)21(19)22(16-6-4-15(13-30)5-7-16)33(24(32)37)23(36)31-25(14-34)10-11-25/h1-7,12,22,34H,8-11,14H2,(H,31,36)
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211754(US9290459, 9A | US9670166, 9A)
Show SMILES CS(=O)(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C22H16F3N3O4S/c1-33(31,32)28-20(14-7-5-13(12-26)6-8-14)19-17(9-10-18(19)29)27(21(28)30)16-4-2-3-15(11-16)22(23,24)25/h2-8,11,20H,9-10H2,1H3/t20-/m1/s1
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM50032889(CHEMBL3342779 | US9290459, 24 | US9670166, 24)
Show SMILES CCN1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C24H20F3N3O4S/c1-3-29-22(17-8-7-14(13-28)11-20(17)35(2,33)34)21-18(9-10-19(21)31)30(23(29)32)16-6-4-5-15(12-16)24(25,26)27/h4-8,11-12,22H,3,9-10H2,1-2H3
Affinity DataEC50:  2nMAssay Description:Inhibition of neutrophil elastase in human plasma using MeOSuc-Ala-Ala-Pro-Val-AMC as substrate by fluorescence assayMore data for this Ligand-Target Pair
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211780(US9290459, 19 | US9670166, 19)
Show SMILES CS(=O)(=O)c1cc(ccc1C1N(CC(O)=O)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C24H18F3N3O6S/c1-37(35,36)19-9-13(11-28)5-6-16(19)22-21-17(7-8-18(21)31)30(23(34)29(22)12-20(32)33)15-4-2-3-14(10-15)24(25,26)27/h2-6,9-10,22H,7-8,12H2,1H3,(H,32,33)
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211801(US9290459, 26A | US9670166, 26A)
Show SMILES CN1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C22H17F2N3O2/c1-26-20(14-7-5-13(12-25)6-8-14)19-17(9-10-18(19)28)27(22(26)29)16-4-2-3-15(11-16)21(23)24/h2-8,11,20-21H,9-10H2,1H3/t20-/m1/s1
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211775(US9290459, 15.4A | US9670166, 15.4A)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1NC(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)F)C#N
Show InChI InChI=1S/C22H17F2N3O4S/c1-32(30,31)18-9-12(11-25)5-6-15(18)20-19-16(7-8-17(19)28)27(22(29)26-20)14-4-2-3-13(10-14)21(23)24/h2-6,9-10,20-21H,7-8H2,1H3,(H,26,29)/t20-/m1/s1
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211950(US9290459, 30B | US9475779, C.2B | US9670166, 30B)
Show SMILES CN1[C@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)=O)C#N
Show InChI InChI=1S/C23H18F3N3O3S/c1-28-21(16-7-6-13(12-27)10-19(16)33(2)32)20-17(8-9-18(20)30)29(22(28)31)15-5-3-4-14(11-15)23(24,25)26/h3-7,10-11,21H,8-9H2,1-2H3/t21-,33?/m0/s1
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM50032889(CHEMBL3342779 | US9290459, 24 | US9670166, 24)
Show SMILES CCN1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C24H20F3N3O4S/c1-3-29-22(17-8-7-14(13-28)11-20(17)35(2,33)34)21-18(9-10-19(21)31)30(23(29)32)16-6-4-5-15(12-16)24(25,26)27/h4-8,11-12,22H,3,9-10H2,1-2H3
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211793(US9290459, 24.1 | US9475779, E.2 | US9670166, 24.1)
Show SMILES CS(=O)(=O)c1cc(ccc1C1N(CCCO)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C25H22F3N3O5S/c1-37(35,36)21-12-15(14-29)6-7-18(21)23-22-19(8-9-20(22)33)31(24(34)30(23)10-3-11-32)17-5-2-4-16(13-17)25(26,27)28/h2,4-7,12-13,23,32H,3,8-11H2,1H3
Affinity DataEC50:  2nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211945(US9290459, 55 | US9670166, 55)
Show SMILES CC(C)(O)CNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1ccnc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C25H22F3N5O4/c1-24(2,37)13-31-22(35)33-21(15-5-3-14(12-29)4-6-15)20-17(7-8-18(20)34)32(23(33)36)16-9-10-30-19(11-16)25(26,27)28/h3-6,9-11,21,37H,7-8,13H2,1-2H3,(H,31,35)
Affinity DataEC50:  3nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211686(US9290459, 2A | US9670166, 2A)
Show SMILES CN1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C22H16F3N3O2/c1-27-20(14-7-5-13(12-26)6-8-14)19-17(9-10-18(19)29)28(21(27)30)16-4-2-3-15(11-16)22(23,24)25/h2-8,11,20H,9-10H2,1H3/t20-/m1/s1
Affinity DataEC50:  3nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM50032887(CHEMBL3342777 | US9290459, 2 | US9670166, 2)
Show SMILES CN1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C22H16F3N3O2/c1-27-20(14-7-5-13(12-26)6-8-14)19-17(9-10-18(19)29)28(21(27)30)16-4-2-3-15(11-16)22(23,24)25/h2-8,11,20H,9-10H2,1H3
Affinity DataEC50:  3nMAssay Description:Inhibition of neutrophil elastase in human plasma using MeOSuc-Ala-Ala-Pro-Val-AMC as substrate by fluorescence assayMore data for this Ligand-Target Pair
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM50032888(CHEMBL3342778 | US9290459, 6.3 | US9670166, 6.3)
Show SMILES FC(F)(F)c1cccc(c1)N1C2=C(C(N(CC(=O)N3CCC3)C1=O)c1ccc(cc1)C#N)C(=O)CC2
Show InChI InChI=1S/C26H21F3N4O3/c27-26(28,29)18-3-1-4-19(13-18)33-20-9-10-21(34)23(20)24(17-7-5-16(14-30)6-8-17)32(25(33)36)15-22(35)31-11-2-12-31/h1,3-8,13,24H,2,9-12,15H2
Affinity DataEC50:  4nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM211912(US9290459, 49A | US9670166, 49A)
Show SMILES CNC(=O)N1[C@@H](C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1F)C#N
Show InChI InChI=1S/C23H16F4N4O3/c1-29-21(33)31-20(15-6-5-12(11-28)9-16(15)24)19-17(7-8-18(19)32)30(22(31)34)14-4-2-3-13(10-14)23(25,26)27/h2-6,9-10,20H,7-8H2,1H3,(H,29,33)/t20-/m1/s1
Affinity DataEC50:  4nMpH: 7.5Assay Description:Various concentrations of the neutrophil elastase inhibitor are incubated with plasma. Subsequently, the enzyme activity is measured using the fluoro...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNeutrophil elastase(Homo sapiens (Human))
Boehringer Ingelheim International GmbH

US Patent
LigandPNGBDBM50032888(CHEMBL3342778 | US9290459, 6.3 | US9670166, 6.3)
Show SMILES FC(F)(F)c1cccc(c1)N1C2=C(C(N(CC(=O)N3CCC3)C1=O)c1ccc(cc1)C#N)C(=O)CC2
Show InChI InChI=1S/C26H21F3N4O3/c27-26(28,29)18-3-1-4-19(13-18)33-20-9-10-21(34)23(20)24(17-7-5-16(14-30)6-8-17)32(25(33)36)15-22(35)31-11-2-12-31/h1,3-8,13,24H,2,9-12,15H2
Affinity DataEC50:  4nMAssay Description:Inhibition of neutrophil elastase in human plasma using MeOSuc-Ala-Ala-Pro-Val-AMC as substrate by fluorescence assayMore data for this Ligand-Target Pair
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