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Patent code US9670166

Compile Data Set for Download or QSAR

Found 297 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Leukocyte elastase


(Homo sapiens (Human))
BDBM211819
PNG
(US9290459, 32.2 | US9670166, 32.2)
Show SMILES CCOC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C25H20F3N3O6S/c1-3-37-24(34)31-22(17-8-7-14(13-29)11-20(17)38(2,35)36)21-18(9-10-19(21)32)30(23(31)33)16-6-4-5-15(12-16)25(26,27)28/h4-8,11-12,22H,3,9-10H2,1-2H3
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211822
PNG
(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
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211846
PNG
(US9290459, 41.9 | US9670166, 41.9)
Show SMILES CCOCCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C26H23F3N4O4/c1-2-37-13-12-31-24(35)33-23(17-8-6-16(15-30)7-9-17)22-20(10-11-21(22)34)32(25(33)36)19-5-3-4-18(14-19)26(27,28)29/h3-9,14,23H,2,10-13H2,1H3,(H,31,35)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211859
PNG
(US9290459, 41.22 | US9670166, 41.22)
Show SMILES Cn1nccc1CNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C27H21F3N6O3/c1-34-20(11-12-33-34)15-32-25(38)36-24(17-7-5-16(14-31)6-8-17)23-21(9-10-22(23)37)35(26(36)39)19-4-2-3-18(13-19)27(28,29)30/h2-8,11-13,24H,9-10,15H2,1H3,(H,32,38)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM187783
PNG
(US9670166, 41.24)
Show SMILES O[C@H]1CCCCC1NC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C28H25F3N4O4/c29-28(30,31)18-4-3-5-19(14-18)34-21-12-13-23(37)24(21)25(17-10-8-16(15-32)9-11-17)35(27(34)39)26(38)33-20-6-1-2-7-22(20)36/h3-5,8-11,14,20,22,25,36H,1-2,6-7,12-13H2,(H,33,38)/t20?,22-,25?/m0/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211865
PNG
(US9290459, 41.28 | US9670166, 41.28)
Show SMILES CCS(=O)(=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/C26H23F3N4O5S/c1-2-39(37,38)13-12-31-24(35)33-23(17-8-6-16(15-30)7-9-17)22-20(10-11-21(22)34)32(25(33)36)19-5-3-4-18(14-19)26(27,28)29/h3-9,14,23H,2,10-13H2,1H3,(H,31,35)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211867
PNG
(US9290459, 41.30 | US9670166, 41.30)
Show SMILES CC1(CCS(=O)(=O)C1)NC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C27H23F3N4O5S/c1-26(11-12-40(38,39)15-26)32-24(36)34-23(17-7-5-16(14-31)6-8-17)22-20(9-10-21(22)35)33(25(34)37)19-4-2-3-18(13-19)27(28,29)30/h2-8,13,23H,9-12,15H2,1H3,(H,32,36)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211891
PNG
(US9290459, 47.6 | US9670166, 47.6)
Show SMILES CC(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)C#N
Show InChI InChI=1S/C26H20F3N5O5S/c1-14(12-30)32-24(36)34-23(18-7-6-15(13-31)10-21(18)40(2,38)39)22-19(8-9-20(22)35)33(25(34)37)17-5-3-4-16(11-17)26(27,28)29/h3-7,10-11,14,23H,8-9H2,1-2H3,(H,32,36)/t14?,23-/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211899
PNG
(US9290459, 47.14 | US9670166, 47.14)
Show SMILES CC(C)(CO)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/C27H25F3N4O6S/c1-26(2,14-35)32-24(37)34-23(18-8-7-15(13-31)11-21(18)41(3,39)40)22-19(9-10-20(22)36)33(25(34)38)17-6-4-5-16(12-17)27(28,29)30/h4-8,11-12,23,35H,9-10,14H2,1-3H3,(H,32,37)/t23-/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211903
PNG
(US9290459, 47.18 | US9670166, 47.18)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)N[C@H]2CCC[C@H]2O)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C28H25F3N4O6S/c1-42(40,41)23-12-15(14-32)8-9-18(23)25-24-20(10-11-22(24)37)34(17-5-2-4-16(13-17)28(29,30)31)27(39)35(25)26(38)33-19-6-3-7-21(19)36/h2,4-5,8-9,12-13,19,21,25,36H,3,6-7,10-11H2,1H3,(H,33,38)/t19-,21+,25+/m0/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211909
PNG
(US9290459, 48.3 | US9670166, 48.3)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)NC2CC(O)C2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C27H23F3N4O6S/c1-41(39,40)22-9-14(13-31)5-6-19(22)24-23-20(7-8-21(23)36)33(17-4-2-3-15(10-17)27(28,29)30)26(38)34(24)25(37)32-16-11-18(35)12-16/h2-6,9-10,16,18,24,35H,7-8,11-12H2,1H3,(H,32,37)/t16?,18?,24-/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211912
PNG
(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
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211925
PNG
(US9290459, 51.2 | US9670166, 51.2)
Show SMILES CCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1Cl)C#N
Show InChI InChI=1S/C24H18ClF3N4O3/c1-2-30-22(34)32-21(16-7-6-13(12-29)10-17(16)25)20-18(8-9-19(20)33)31(23(32)35)15-5-3-4-14(11-15)24(26,27)28/h3-7,10-11,21H,2,8-9H2,1H3,(H,30,34)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211926
PNG
(US9290459, 51.3 | US9670166, 51.3)
Show SMILES CCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(=O)(=O)CC)C#N
Show InChI InChI=1S/C26H23F3N4O5S/c1-3-31-24(35)33-23(18-9-8-15(14-30)12-21(18)39(37,38)4-2)22-19(10-11-20(22)34)32(25(33)36)17-7-5-6-16(13-17)26(27,28)29/h5-9,12-13,23H,3-4,10-11H2,1-2H3,(H,31,35)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211936
PNG
(US9290459, 53.1 | US9670166, 53.1)
Show SMILES CNC(=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/C24H20F2N4O5S/c1-28-23(32)30-21(16-7-6-13(12-27)10-19(16)36(2,34)35)20-17(8-9-18(20)31)29(24(30)33)15-5-3-4-14(11-15)22(25)26/h3-7,10-11,21-22H,8-9H2,1-2H3,(H,28,32)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211946
PNG
(US9290459, 56.1 | US9670166, 56.1)
Show SMILES CNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1ccnc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C23H18F3N5O5S/c1-28-21(33)31-20(14-4-3-12(11-27)9-17(14)37(2,35)36)19-15(5-6-16(19)32)30(22(31)34)13-7-8-29-18(10-13)23(24,25)26/h3-4,7-10,20H,5-6H2,1-2H3,(H,28,33)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211947
PNG
(US9290459, 56.2 | US9475779, D.4.10 | US9670166, 5...)
Show SMILES CCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1ccnc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C24H20F3N5O5S/c1-3-29-22(34)32-21(15-5-4-13(12-28)10-18(15)38(2,36)37)20-16(6-7-17(20)33)31(23(32)35)14-8-9-30-19(11-14)24(25,26)27/h4-5,8-11,21H,3,6-7H2,1-2H3,(H,29,34)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211738
PNG
(US9290459, 7.2 | US9670166, 7.2)
Show SMILES OCCNC(=O)N1C(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)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM187194
PNG
(US9670166, 7.10)
Show SMILES CN(CCS(C)(=O)=O)C(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C26H23F3N4O5S/c1-31(12-13-39(2,37)38)24(35)33-23(17-8-6-16(15-30)7-9-17)22-20(10-11-21(22)34)32(25(33)36)19-5-3-4-18(14-19)26(27,28)29/h3-9,14,23H,10-13H2,1-2H3
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211798
PNG
(US9290459, 24.6 | US9670166, 24.6)
Show SMILES CS(=O)(=O)c1cc(ccc1C1N(CCC2CCOCC2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C29H28F3N3O5S/c1-41(38,39)25-15-19(17-33)5-6-22(25)27-26-23(7-8-24(26)36)35(21-4-2-3-20(16-21)29(30,31)32)28(37)34(27)12-9-18-10-13-40-14-11-18/h2-6,15-16,18,27H,7-14H2,1H3
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211818
PNG
(US9290459, 32.1 | US9670166, 32.1)
Show SMILES COC(=O)N1C(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
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211839
PNG
(US9290459, 41.2 | US9670166, 41.2)
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?/m1/s1
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n/an/a 1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211844
PNG
(US9290459, 41.7 | US9670166, 41.7)
Show SMILES FC(F)(F)c1cccc(c1)N1C2=C(C(N(C(=O)N[C@@H]3CCOC3)C1=O)c1ccc(cc1)C#N)C(=O)CC2
Show InChI InChI=1S/C26H21F3N4O4/c27-26(28,29)17-2-1-3-19(12-17)32-20-8-9-21(34)22(20)23(16-6-4-15(13-30)5-7-16)33(25(32)36)24(35)31-18-10-11-37-14-18/h1-7,12,18,23H,8-11,14H2,(H,31,35)/t18-,23?/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211854
PNG
(US9290459, 41.17 | US9670166, 41.17)
Show SMILES CC(C)(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/C27H25F3N4O4/c1-26(2,38)12-13-32-24(36)34-23(17-8-6-16(15-31)7-9-17)22-20(10-11-21(22)35)33(25(34)37)19-5-3-4-18(14-19)27(28,29)30/h3-9,14,23,38H,10-13H2,1-2H3,(H,32,36)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM187785
PNG
(US9670166, 41.26)
Show SMILES CO[C@H]1CCC[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/C28H25F3N4O4/c1-39-23-7-3-6-20(23)33-26(37)35-25(17-10-8-16(15-32)9-11-17)24-21(12-13-22(24)36)34(27(35)38)19-5-2-4-18(14-19)28(29,30)31/h2,4-5,8-11,14,20,23,25H,3,6-7,12-13H2,1H3,(H,33,37)/t20-,23-,25?/m0/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211870
PNG
(US9290459, 42.1 | US9670166, 42.1)
Show SMILES O[C@@H]1CCC[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/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
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211876
PNG
(US9290459, 42.7 | US9670166, 42.7)
Show SMILES FC(F)(F)c1cccc(c1)N1C2=C(C(N(C(=O)NC3CCSCC3)C1=O)c1ccc(cc1)C#N)C(=O)CC2
Show InChI InChI=1S/C27H23F3N4O3S/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)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211882
PNG
(US9290459, 45.3 | US9670166, 45.3)
Show SMILES FC(F)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/C24H17F5N4O3/c25-19(26)12-31-22(35)33-21(14-6-4-13(11-30)5-7-14)20-17(8-9-18(20)34)32(23(33)36)16-3-1-2-15(10-16)24(27,28)29/h1-7,10,19,21H,8-9,12H2,(H,31,35)/t21-/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211887
PNG
(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
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211892
PNG
(US9290459, 47.7 | US9670166, 47.7)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)NCC2CC2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C27H23F3N4O5S/c1-40(38,39)22-11-16(13-31)7-8-19(22)24-23-20(9-10-21(23)35)33(18-4-2-3-17(12-18)27(28,29)30)26(37)34(24)25(36)32-14-15-5-6-15/h2-4,7-8,11-12,15,24H,5-6,9-10,14H2,1H3,(H,32,36)/t24-/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211893
PNG
(US9290459, 47.8 | US9670166, 47.8)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)NC2COC2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C26H21F3N4O6S/c1-40(37,38)21-9-14(11-30)5-6-18(21)23-22-19(7-8-20(22)34)32(17-4-2-3-15(10-17)26(27,28)29)25(36)33(23)24(35)31-16-12-39-13-16/h2-6,9-10,16,23H,7-8,12-13H2,1H3,(H,31,35)/t23-/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211904
PNG
(US9290459, 47.19 | US9670166, 47.19)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)N[C@H]2CCC[C@@H]2O)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C28H25F3N4O6S/c1-42(40,41)23-12-15(14-32)8-9-18(23)25-24-20(10-11-22(24)37)34(17-5-2-4-16(13-17)28(29,30)31)27(39)35(25)26(38)33-19-6-3-7-21(19)36/h2,4-5,8-9,12-13,19,21,25,36H,3,6-7,10-11H2,1H3,(H,33,38)/t19-,21-,25+/m0/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM188476
PNG
(US9670166, 47.21)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)N[C@H]2CCCC[C@@H]2O)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C29H27F3N4O6S/c1-43(41,42)24-13-16(15-33)9-10-19(24)26-25-21(11-12-23(25)38)35(18-6-4-5-17(14-18)29(30,31)32)28(40)36(26)27(39)34-20-7-2-3-8-22(20)37/h4-6,9-10,13-14,20,22,26,37H,2-3,7-8,11-12H2,1H3,(H,34,39)/t20-,22-,26+/m0/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211907
PNG
(US9290459, 48.1 | US9670166, 48.4)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)NC2(CC2)C#N)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C27H20F3N5O5S/c1-41(39,40)21-11-15(13-31)5-6-18(21)23-22-19(7-8-20(22)36)34(17-4-2-3-16(12-17)27(28,29)30)25(38)35(23)24(37)33-26(14-32)9-10-26/h2-6,11-12,23H,7-10H2,1H3,(H,33,37)/t23-/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211927
PNG
(US9290459, 51.4 | US9475779, C.3 | US9670166, 51.4)
Show SMILES CCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)=O)C#N
Show InChI InChI=1S/C25H21F3N4O4S/c1-3-30-23(34)32-22(17-8-7-14(13-29)11-20(17)37(2)36)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)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211934
PNG
(US9290459, 52.4 | US9670166, 52.4)
Show SMILES COCCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C25H22F2N4O4/c1-35-12-11-29-24(33)31-22(16-7-5-15(14-28)6-8-16)21-19(9-10-20(21)32)30(25(31)34)18-4-2-3-17(13-18)23(26)27/h2-8,13,22-23H,9-12H2,1H3,(H,29,33)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211939
PNG
(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)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211748
PNG
(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
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211740
PNG
(US9290459, 7.4 | US9670166, 7.4)
Show SMILES COCCNC(=O)N1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1)C#N
Show InChI InChI=1S/C25H21F3N4O4/c1-36-12-11-30-23(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)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211790
PNG
(US9290459, 22.8 | US9670166, 22.8)
Show SMILES COC1CCN(CC1)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/C30H29F3N4O6S/c1-43-21-10-12-35(13-11-21)26(39)17-36-28(22-7-6-18(16-34)14-25(22)44(2,41)42)27-23(8-9-24(27)38)37(29(36)40)20-5-3-4-19(15-20)30(31,32)33/h3-7,14-15,21,28H,8-13,17H2,1-2H3
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211796
PNG
(US9290459, 24.4 | US9670166, 24.4)
Show SMILES COCCCN1C(C2=C(CCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(=O)=O)C#N
Show InChI InChI=1S/C26H24F3N3O5S/c1-37-12-4-11-31-24(19-8-7-16(15-30)13-22(19)38(2,35)36)23-20(9-10-21(23)33)32(25(31)34)18-6-3-5-17(14-18)26(27,28)29/h3,5-8,13-14,24H,4,9-12H2,1-2H3
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n/an/a 1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211840
PNG
(US9290459, 41.3 | US9670166, 41.3)
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?/m0/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211851
PNG
(US9290459, 41.14 | US9670166, 41.14)
Show SMILES FC(F)(F)c1cccc(c1)N1C2=C(C(N(C(=O)N[C@H]3CCCOC3)C1=O)c1ccc(cc1)C#N)C(=O)CC2
Show InChI InChI=1S/C27H23F3N4O4/c28-27(29,30)18-3-1-5-20(13-18)33-21-10-11-22(35)23(21)24(17-8-6-16(14-31)7-9-17)34(26(33)37)25(36)32-19-4-2-12-38-15-19/h1,3,5-9,13,19,24H,2,4,10-12,15H2,(H,32,36)/t19-,24?/m0/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211852
PNG
(US9290459, 41.15 | US9670166, 41.15)
Show SMILES FC(F)(F)c1cccc(c1)N1C2=C(C(N(C(=O)N[C@@H]3CCCOC3)C1=O)c1ccc(cc1)C#N)C(=O)CC2
Show InChI InChI=1S/C27H23F3N4O4/c28-27(29,30)18-3-1-5-20(13-18)33-21-10-11-22(35)23(21)24(17-8-6-16(14-31)7-9-17)34(26(33)37)25(36)32-19-4-2-12-38-15-19/h1,3,5-9,13,19,24H,2,4,10-12,15H2,(H,32,36)/t19-,24?/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211873
PNG
(US9290459, 42.4 | US9670166, 42.4)
Show SMILES O[C@H]1CCC[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/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
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211877
PNG
(US9290459, 42.8 | US9670166, 42.8)
Show SMILES FC(F)(F)c1cccc(c1)N1C2=C(C(N(C(=O)NC3CCCS(=O)(=O)C3)C1=O)c1ccc(cc1)C#N)C(=O)CC2
Show InChI InChI=1S/C27H23F3N4O5S/c28-27(29,30)18-3-1-5-20(13-18)33-21-10-11-22(35)23(21)24(17-8-6-16(14-31)7-9-17)34(26(33)37)25(36)32-19-4-2-12-40(38,39)15-19/h1,3,5-9,13,19,24H,2,4,10-12,15H2,(H,32,36)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211879
PNG
(US9290459, 44 | US9670166, 44)
Show SMILES FC(F)(F)c1cccc(c1)N1C2=C(C(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)
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211888
PNG
(US9290459, 47.3 | US9670166, 47.3)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)NCC#N)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C25H18F3N5O5S/c1-39(37,38)20-11-14(13-30)5-6-17(20)22-21-18(7-8-19(21)34)32(24(36)33(22)23(35)31-10-9-29)16-4-2-3-15(12-16)25(26,27)28/h2-6,11-12,22H,7-8,10H2,1H3,(H,31,35)/t22-/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211890
PNG
(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
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM211896
PNG
(US9290459, 47.11 | US9670166, 47.11)
Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)NCC2(O)CC2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N
Show InChI InChI=1S/C27H23F3N4O6S/c1-41(39,40)21-11-15(13-31)5-6-18(21)23-22-19(7-8-20(22)35)33(17-4-2-3-16(12-17)27(28,29)30)25(37)34(23)24(36)32-14-26(38)9-10-26/h2-6,11-12,23,38H,7-10,14H2,1H3,(H,32,36)/t23-/m1/s1
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n/an/a<1n/an/an/an/a7.525



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat. No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bach...


US Patent US9670166 (2017)


BindingDB Entry DOI: 10.7270/Q25Q4T8F
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 297 total )  |  Next  |  Last  >>
* indicates data uncertainty>20%