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Compile Data Set for Download or QSAR

Found 253 hits Enz. Inhib. hit(s) with all data for entry = 8529   
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
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255962
PNG
(US9481672, 140)
Show SMILES CCn1c2cc(ccc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2Cl)C(F)(F)F)c1=O
Show InChI InChI=1S/C23H18ClF3N4O5/c1-3-29-17-9-13(7-8-16(17)28(2)21(29)35)30-11-14(20(33)34)19(32)31(22(30)36)10-12-5-4-6-15(18(12)24)23(25,26)27/h4-9,11H,3,10H2,1-2H3,(H,33,34)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255964
PNG
(US9481672, 142)
Show SMILES Cn1c2ccc(cc2n(CC(F)(F)F)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(Cl)c2C(F)(F)F)c1=O
Show InChI InChI=1S/C23H15ClF6N4O5/c1-31-15-6-5-12(7-16(15)34(20(31)38)10-22(25,26)27)32-9-13(19(36)37)18(35)33(21(32)39)8-11-3-2-4-14(24)17(11)23(28,29)30/h2-7,9H,8,10H2,1H3,(H,36,37)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255968
PNG
(US9481672, 146)
Show SMILES Cc1c(Cn2c(=O)c(cn(-c3ccc4n(C)c(=O)n(CC5CC5)c4c3)c2=O)C(O)=O)cccc1C(F)(F)F
Show InChI InChI=1S/C26H23F3N4O5/c1-14-16(4-3-5-19(14)26(27,28)29)12-33-22(34)18(23(35)36)13-31(25(33)38)17-8-9-20-21(10-17)32(11-15-6-7-15)24(37)30(20)2/h3-5,8-10,13,15H,6-7,11-12H2,1-2H3,(H,35,36)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256036
PNG
(US9481672, 217)
Show SMILES CC(C)n1c2cc(ccc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C26H23F3N4O5/c1-13(2)32-21-11-14(7-9-20(21)30(3)24(32)37)31-12-17(23(35)36)22(34)33(25(31)38)19-10-8-15-16(19)5-4-6-18(15)26(27,28)29/h4-7,9,11-13,19H,8,10H2,1-3H3,(H,35,36)/t19-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256064
PNG
(US9481672, 246)
Show SMILES Cn1c2ccc(cc2n(CC(O)C(F)(F)F)c1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C26H20F6N4O6/c1-33-18-7-5-12(9-19(18)35(23(33)41)11-20(37)26(30,31)32)34-10-15(22(39)40)21(38)36(24(34)42)17-8-6-13-14(17)3-2-4-16(13)25(27,28)29/h2-5,7,9-10,17,20,37H,6,8,11H2,1H3,(H,39,40)/t17-,20?/m1/s1
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The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256065
PNG
(US9481672, 247)
Show SMILES Cn1c2ccc(cc2n(CCC(F)(F)F)c1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C26H20F6N4O5/c1-33-19-7-5-13(11-20(19)34(23(33)40)10-9-25(27,28)29)35-12-16(22(38)39)21(37)36(24(35)41)18-8-6-14-15(18)3-2-4-17(14)26(30,31)32/h2-5,7,11-12,18H,6,8-10H2,1H3,(H,38,39)/t18-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256099
PNG
(US9481672, 281)
Show SMILES Cn1c2ccc(cc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C25H21F3N4O5/c1-29-19-10-9-13(11-20(19)30(2)23(29)36)31-12-16(22(34)35)21(33)32(24(31)37)18-8-4-5-14-15(18)6-3-7-17(14)25(26,27)28/h3,6-7,9-12,18H,4-5,8H2,1-2H3,(H,34,35)/t18-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255927
PNG
(US9481672, 104)
Show SMILES CCOC(=O)c1cn(-c2cc3n(C)c(=O)n(C)c3cc2F)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C26H22F4N4O5/c1-4-39-23(36)15-12-33(19-11-21-20(10-17(19)27)31(2)24(37)32(21)3)25(38)34(22(15)35)18-9-8-13-14(18)6-5-7-16(13)26(28,29)30/h5-7,10-12,18H,4,8-9H2,1-3H3/t18-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255944
PNG
(US9481672, 122)
Show SMILES Cn1c2ccc(cc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2C(F)(F)F)C(F)(F)F)c1=O
Show InChI InChI=1S/C23H16F6N4O5/c1-30-15-7-6-12(8-16(15)31(2)20(30)37)32-10-13(19(35)36)18(34)33(21(32)38)9-11-4-3-5-14(22(24,25)26)17(11)23(27,28)29/h3-8,10H,9H2,1-2H3,(H,35,36)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255954
PNG
(US9481672, 132)
Show SMILES Cn1c2ccc(cc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C24H19F3N4O5/c1-28-18-8-6-12(10-19(18)29(2)22(28)35)30-11-15(21(33)34)20(32)31(23(30)36)17-9-7-13-14(17)4-3-5-16(13)24(25,26)27/h3-6,8,10-11,17H,7,9H2,1-2H3,(H,33,34)/t17-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255956
PNG
(US9481672, 134)
Show SMILES Cn1c2cc(F)c(cc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C24H18F4N4O5/c1-29-18-8-15(25)17(9-19(18)30(2)22(29)36)31-10-13(21(34)35)20(33)32(23(31)37)16-7-6-11-12(16)4-3-5-14(11)24(26,27)28/h3-5,8-10,16H,6-7H2,1-2H3,(H,34,35)/t16-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255958
PNG
(US9481672, 136)
Show SMILES CCn1c2ccc(cc2n(CC)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2C)C(F)(F)F)c1=O
Show InChI InChI=1S/C25H23F3N4O5/c1-4-29-19-10-9-16(11-20(19)30(5-2)23(29)36)31-13-17(22(34)35)21(33)32(24(31)37)12-15-7-6-8-18(14(15)3)25(26,27)28/h6-11,13H,4-5,12H2,1-3H3,(H,34,35)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255961
PNG
(US9481672, 139)
Show SMILES CCn1c2cc(ccc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(Cl)c2C(F)(F)F)c1=O
Show InChI InChI=1S/C23H18ClF3N4O5/c1-3-29-17-9-13(7-8-16(17)28(2)21(29)35)30-11-14(20(33)34)19(32)31(22(30)36)10-12-5-4-6-15(24)18(12)23(25,26)27/h4-9,11H,3,10H2,1-2H3,(H,33,34)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255963
PNG
(US9481672, 141)
Show SMILES CCn1c2cc(ccc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2C)C(F)(F)F)c1=O
Show InChI InChI=1S/C24H21F3N4O5/c1-4-29-19-10-15(8-9-18(19)28(3)22(29)35)30-12-16(21(33)34)20(32)31(23(30)36)11-14-6-5-7-17(13(14)2)24(25,26)27/h5-10,12H,4,11H2,1-3H3,(H,33,34)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255965
PNG
(US9481672, 143)
Show SMILES Cn1c2ccc(cc2n(CC(F)(F)F)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2Cl)C(F)(F)F)c1=O
Show InChI InChI=1S/C23H15ClF6N4O5/c1-31-15-6-5-12(7-16(15)34(20(31)38)10-22(25,26)27)32-9-13(19(36)37)18(35)33(21(32)39)8-11-3-2-4-14(17(11)24)23(28,29)30/h2-7,9H,8,10H2,1H3,(H,36,37)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255966
PNG
(US9481672, 144)
Show SMILES Cc1c(Cn2c(=O)c(cn(-c3ccc4n(C)c(=O)n(CC(F)(F)F)c4c3)c2=O)C(O)=O)cccc1C(F)(F)F
Show InChI InChI=1S/C24H18F6N4O5/c1-12-13(4-3-5-16(12)24(28,29)30)9-33-19(35)15(20(36)37)10-32(22(33)39)14-6-7-17-18(8-14)34(11-23(25,26)27)21(38)31(17)2/h3-8,10H,9,11H2,1-2H3,(H,36,37)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255967
PNG
(US9481672, 145)
Show SMILES Cn1c2ccc(cc2n(CC2CC2)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2Cl)C(F)(F)F)c1=O
Show InChI InChI=1S/C25H20ClF3N4O5/c1-30-18-8-7-15(9-19(18)32(23(30)37)10-13-5-6-13)31-12-16(22(35)36)21(34)33(24(31)38)11-14-3-2-4-17(20(14)26)25(27,28)29/h2-4,7-9,12-13H,5-6,10-11H2,1H3,(H,35,36)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255969
PNG
(US9481672, 147)
Show SMILES Cn1c2ccc(cc2n(CC2CC2)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(Cl)c2C(F)(F)F)c1=O
Show InChI InChI=1S/C25H20ClF3N4O5/c1-30-18-8-7-15(9-19(18)32(23(30)37)10-13-5-6-13)31-12-16(22(35)36)21(34)33(24(31)38)11-14-3-2-4-17(26)20(14)25(27,28)29/h2-4,7-9,12-13H,5-6,10-11H2,1H3,(H,35,36)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255971
PNG
(US9481672, 149)
Show SMILES Cc1c(Cn2c(=O)c(cn(-c3ccc4n(C)c(=O)n(C5CCC5)c4c3)c2=O)C(O)=O)cccc1C(F)(F)F
Show InChI InChI=1S/C26H23F3N4O5/c1-14-15(5-3-8-19(14)26(27,28)29)12-32-22(34)18(23(35)36)13-31(25(32)38)17-9-10-20-21(11-17)33(16-6-4-7-16)24(37)30(20)2/h3,5,8-11,13,16H,4,6-7,12H2,1-2H3,(H,35,36)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255973
PNG
(US9481672, 151)
Show SMILES CC(C)n1c2cc(ccc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2C)C(F)(F)F)c1=O
Show InChI InChI=1S/C25H23F3N4O5/c1-13(2)32-20-10-16(8-9-19(20)29(4)23(32)36)30-12-17(22(34)35)21(33)31(24(30)37)11-15-6-5-7-18(14(15)3)25(26,27)28/h5-10,12-13H,11H2,1-4H3,(H,34,35)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256043
PNG
(US9481672, 224)
Show SMILES CN1C(=O)C(C)(C)c2cc(ccc12)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C26H22F3N3O5/c1-25(2)18-11-13(7-9-20(18)30(3)23(25)36)31-12-16(22(34)35)21(33)32(24(31)37)19-10-8-14-15(19)5-4-6-17(14)26(27,28)29/h4-7,9,11-12,19H,8,10H2,1-3H3,(H,34,35)/t19-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256046
PNG
(US9481672, 227)
Show SMILES CN1C(=O)C2(CC2)c2cc(ccc12)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C26H20F3N3O5/c1-30-20-7-5-13(11-18(20)25(9-10-25)23(30)36)31-12-16(22(34)35)21(33)32(24(31)37)19-8-6-14-15(19)3-2-4-17(14)26(27,28)29/h2-5,7,11-12,19H,6,8-10H2,1H3,(H,34,35)/t19-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256059
PNG
(US9481672, 241)
Show SMILES Cn1c2ccc(cc2n(CC(F)(F)F)c1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C25H18F6N4O5/c1-32-18-7-5-12(9-19(18)34(22(32)39)11-24(26,27)28)33-10-15(21(37)38)20(36)35(23(33)40)17-8-6-13-14(17)3-2-4-16(13)25(29,30)31/h2-5,7,9-10,17H,6,8,11H2,1H3,(H,37,38)/t17-/m1/s1
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The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256062
PNG
(US9481672, 244)
Show SMILES CCn1c2cc(ccc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C25H21F3N4O5/c1-3-30-20-11-13(7-9-19(20)29(2)23(30)36)31-12-16(22(34)35)21(33)32(24(31)37)18-10-8-14-15(18)5-4-6-17(14)25(26,27)28/h4-7,9,11-12,18H,3,8,10H2,1-2H3,(H,34,35)/t18-/m1/s1
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The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256066
PNG
(US9481672, 248)
Show SMILES Cn1c2ccc(cc2n(C2CC2)c1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C26H21F3N4O5/c1-30-20-9-7-14(11-21(20)32(24(30)37)13-5-6-13)31-12-17(23(35)36)22(34)33(25(31)38)19-10-8-15-16(19)3-2-4-18(15)26(27,28)29/h2-4,7,9,11-13,19H,5-6,8,10H2,1H3,(H,35,36)/t19-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256083
PNG
(US9481672, 265)
Show SMILES CCN1C(=O)C(C)(C)c2ccc(cc12)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2Cl)C(F)(F)F)c1=O
Show InChI InChI=1S/C25H21ClF3N3O5/c1-4-30-18-10-14(8-9-16(18)24(2,3)22(30)36)31-12-15(21(34)35)20(33)32(23(31)37)11-13-6-5-7-17(19(13)26)25(27,28)29/h5-10,12H,4,11H2,1-3H3,(H,34,35)
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The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256088
PNG
(BDBM256092 | BDBM256093 | US9481672, 270)
Show SMILES Cn1c2ccc(cc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n(C2CCCc3c(Cl)cccc23)c1=O
Show InChI InChI=1S/C24H21ClN4O5/c1-26-19-10-9-13(11-20(19)27(2)23(26)33)28-12-16(22(31)32)21(30)29(24(28)34)18-8-4-5-14-15(18)6-3-7-17(14)25/h3,6-7,9-12,18H,4-5,8H2,1-2H3,(H,31,32)
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The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256095
PNG
(US9481672, 277)
Show SMILES Cn1c2ccc(cc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n(C2CCCc3c2cccc3C(F)(F)F)c1=O
Show InChI InChI=1S/C25H21F3N4O5/c1-29-19-10-9-13(11-20(19)30(2)23(29)36)31-12-16(22(34)35)21(33)32(24(31)37)18-8-4-5-14-15(18)6-3-7-17(14)25(26,27)28/h3,6-7,9-12,18H,4-5,8H2,1-2H3,(H,34,35)
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The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256111
PNG
(US9481672, 294)
Show SMILES Cn1c2ccc(cc2oc1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C24H18F3N3O6/c1-28-18-9-8-12(10-19(18)36-23(28)35)29-11-15(21(32)33)20(31)30(22(29)34)17-7-3-4-13-14(17)5-2-6-16(13)24(25,26)27/h2,5-6,8-11,17H,3-4,7H2,1H3,(H,32,33)/t17-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256116
PNG
(US9481672, 300)
Show SMILES Cn1c2ccc(cc2sc1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C24H18F3N3O5S/c1-28-18-9-8-12(10-19(18)36-23(28)35)29-11-15(21(32)33)20(31)30(22(29)34)17-7-3-4-13-14(17)5-2-6-16(13)24(25,26)27/h2,5-6,8-11,17H,3-4,7H2,1H3,(H,32,33)/t17-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255939
PNG
(US9481672, 117)
Show SMILES CCOC(=O)c1cn(-c2ccc3n(C)c(=O)n(C4CC4)c3c2)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C28H25F3N4O5/c1-3-40-25(37)19-14-33(16-9-11-22-23(13-16)34(15-7-8-15)26(38)32(22)2)27(39)35(24(19)36)21-12-10-17-18(21)5-4-6-20(17)28(29,30)31/h4-6,9,11,13-15,21H,3,7-8,10,12H2,1-2H3/t21-/m1/s1
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The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255943
PNG
(US9481672, 121)
Show SMILES Cc1c(Cn2c(=O)c(cn(-c3ccc4n(C)c(=O)n(C)c4c3)c2=O)C(O)=O)cccc1C(F)(F)F
Show InChI InChI=1S/C23H19F3N4O5/c1-12-13(5-4-6-16(12)23(24,25)26)10-30-19(31)15(20(32)33)11-29(22(30)35)14-7-8-17-18(9-14)28(3)21(34)27(17)2/h4-9,11H,10H2,1-3H3,(H,32,33)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256011
PNG
(US9481672, 189)
Show SMILES Cn1c2ccc(cc2oc1=O)-n1cc(C(O)=O)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C23H16F3N3O6/c1-27-17-7-5-11(9-18(17)35-22(27)34)28-10-14(20(31)32)19(30)29(21(28)33)16-8-6-12-13(16)3-2-4-15(12)23(24,25)26/h2-5,7,9-10,16H,6,8H2,1H3,(H,31,32)/t16-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256027
PNG
(US9481672, 205)
Show SMILES CN1C(=O)C(C)(C)c2ccc(cc12)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2C)C(F)(F)F)c1=O
Show InChI InChI=1S/C25H22F3N3O5/c1-13-14(6-5-7-17(13)25(26,27)28)11-31-20(32)16(21(33)34)12-30(23(31)36)15-8-9-18-19(10-15)29(4)22(35)24(18,2)3/h5-10,12H,11H2,1-4H3,(H,33,34)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256028
PNG
(US9481672, 206)
Show SMILES CN1C(=O)C(C)(C)c2ccc(cc12)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2Cl)C(F)(F)F)c1=O
Show InChI InChI=1S/C24H19ClF3N3O5/c1-23(2)15-8-7-13(9-17(15)29(3)21(23)35)30-11-14(20(33)34)19(32)31(22(30)36)10-12-5-4-6-16(18(12)25)24(26,27)28/h4-9,11H,10H2,1-3H3,(H,33,34)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256042
PNG
(US9481672, 223)
Show SMILES CN1C(=O)C(C)(C)c2cc(ccc12)-n1cc(C(O)=O)c(=O)n(C2CCc3c2cccc3C(F)(F)F)c1=O
Show InChI InChI=1S/C26H22F3N3O5/c1-25(2)18-11-13(7-9-20(18)30(3)23(25)36)31-12-16(22(34)35)21(33)32(24(31)37)19-10-8-14-15(19)5-4-6-17(14)26(27,28)29/h4-7,9,11-12,19H,8,10H2,1-3H3,(H,34,35)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256045
PNG
(US9481672, 226)
Show SMILES CN1C(=O)C2(CC2)c2cc(ccc12)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2C)C(F)(F)F)c1=O
Show InChI InChI=1S/C25H20F3N3O5/c1-13-14(4-3-5-17(13)25(26,27)28)11-31-20(32)16(21(33)34)12-30(23(31)36)15-6-7-19-18(10-15)24(8-9-24)22(35)29(19)2/h3-7,10,12H,8-9,11H2,1-2H3,(H,33,34)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256113
PNG
(US9481672, 296)
Show SMILES Cn1c2ccc(cc2sc1=O)-n1cc(C(O)=O)c(=O)n(C2CCCc3c2cccc3C(F)(F)F)c1=O
Show InChI InChI=1S/C24H18F3N3O5S/c1-28-18-9-8-12(10-19(18)36-23(28)35)29-11-15(21(32)33)20(31)30(22(29)34)17-7-3-4-13-14(17)5-2-6-16(13)24(25,26)27/h2,5-6,8-11,17H,3-4,7H2,1H3,(H,32,33)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255885
PNG
(US9481672, 28)
Show SMILES CCOC(=O)c1cn(-c2ccc3n(C)c(=O)n(CC(F)(F)F)c3c2)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C27H22F6N4O5/c1-3-42-23(39)17-12-35(14-7-9-20-21(11-14)36(13-26(28,29)30)24(40)34(20)2)25(41)37(22(17)38)19-10-8-15-16(19)5-4-6-18(15)27(31,32)33/h4-7,9,11-12,19H,3,8,10,13H2,1-2H3/t19-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255886
PNG
(US9481672, 33)
Show SMILES CCOC(=O)c1cn(-c2ccc3n(C)c(=O)n(C4CCC4)c3c2)c(=O)n(Cc2cccc(c2C)C(F)(F)F)c1=O
Show InChI InChI=1S/C28H27F3N4O5/c1-4-40-25(37)20-15-33(19-11-12-22-23(13-19)35(18-8-6-9-18)26(38)32(22)3)27(39)34(24(20)36)14-17-7-5-10-21(16(17)2)28(29,30)31/h5,7,10-13,15,18H,4,6,8-9,14H2,1-3H3
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255910
PNG
(US9481672, 67)
Show SMILES CCOC(=O)c1cn(-c2ccc3N(C)C(=O)C4(CC4)c3c2)c(=O)n([C@@H]2CCc3c2cccc3C(F)(F)F)c1=O |r|
Show InChI InChI=1S/C28H24F3N3O5/c1-3-39-24(36)18-14-33(15-7-9-22-20(13-15)27(11-12-27)25(37)32(22)2)26(38)34(23(18)35)21-10-8-16-17(21)5-4-6-19(16)28(29,30)31/h4-7,9,13-14,21H,3,8,10-12H2,1-2H3/t21-/m1/s1
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255945
PNG
(US9481672, 123)
Show SMILES Cn1c2ccc(cc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2Cl)C(F)(F)F)c1=O
Show InChI InChI=1S/C22H16ClF3N4O5/c1-27-15-7-6-12(8-16(15)28(2)20(27)34)29-10-13(19(32)33)18(31)30(21(29)35)9-11-4-3-5-14(17(11)23)22(24,25)26/h3-8,10H,9H2,1-2H3,(H,32,33)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255953
PNG
(US9481672, 131)
Show SMILES Cn1c2ccc(cc2n(C)c1=O)-n1cc(C(O)=O)c(=O)n(C2CCc3c2cccc3C(F)(F)F)c1=O
Show InChI InChI=1S/C24H19F3N4O5/c1-28-18-8-6-12(10-19(18)29(2)22(28)35)30-11-15(21(33)34)20(32)31(23(30)36)17-9-7-13-14(17)4-3-5-16(13)24(25,26)27/h3-6,8,10-11,17H,7,9H2,1-2H3,(H,33,34)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255957
PNG
(US9481672, 135)
Show SMILES CCn1c2ccc(cc2n(CC)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2Cl)C(F)(F)F)c1=O
Show InChI InChI=1S/C24H20ClF3N4O5/c1-3-29-17-9-8-14(10-18(17)30(4-2)22(29)36)31-12-15(21(34)35)20(33)32(23(31)37)11-13-6-5-7-16(19(13)25)24(26,27)28/h5-10,12H,3-4,11H2,1-2H3,(H,34,35)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255959
PNG
(US9481672, 137)
Show SMILES CCn1c2ccc(cc2n(CC)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(Cl)c2Cl)c1=O
Show InChI InChI=1S/C23H20Cl2N4O5/c1-3-26-17-9-8-14(10-18(17)27(4-2)22(26)33)28-12-15(21(31)32)20(30)29(23(28)34)11-13-6-5-7-16(24)19(13)25/h5-10,12H,3-4,11H2,1-2H3,(H,31,32)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255960
PNG
(US9481672, 138)
Show SMILES CCn1c2ccc(cc2n(CC)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(F)c2C(F)(F)F)c1=O
Show InChI InChI=1S/C24H20F4N4O5/c1-3-29-17-9-8-14(10-18(17)30(4-2)22(29)36)31-12-15(21(34)35)20(33)32(23(31)37)11-13-6-5-7-16(25)19(13)24(26,27)28/h5-10,12H,3-4,11H2,1-2H3,(H,34,35)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255970
PNG
(US9481672, 148)
Show SMILES Cn1c2ccc(cc2n(CC2CCO2)c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2Cl)C(F)(F)F)c1=O
Show InChI InChI=1S/C25H20ClF3N4O6/c1-30-18-6-5-14(9-19(18)32(23(30)37)11-15-7-8-39-15)31-12-16(22(35)36)21(34)33(24(31)38)10-13-3-2-4-17(20(13)26)25(27,28)29/h2-6,9,12,15H,7-8,10-11H2,1H3,(H,35,36)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255975
PNG
(US9481672, 153)
Show SMILES Cc1c(Cn2c(=O)c(cn(-c3ccc4n(CC5CC5)c(=O)n(C)c4c3)c2=O)C(O)=O)cccc1C(F)(F)F
Show InChI InChI=1S/C26H23F3N4O5/c1-14-16(4-3-5-19(14)26(27,28)29)12-33-22(34)18(23(35)36)13-31(25(33)38)17-8-9-20-21(10-17)30(2)24(37)32(20)11-15-6-7-15/h3-5,8-10,13,15H,6-7,11-12H2,1-2H3,(H,35,36)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM255976
PNG
(US9481672, 154)
Show SMILES Cn1nnc2cc(ccc12)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2Cl)C(F)(F)F)c1=O
Show InChI InChI=1S/C20H13ClF3N5O4/c1-27-15-6-5-11(7-14(15)25-26-27)28-9-12(18(31)32)17(30)29(19(28)33)8-10-3-2-4-13(16(10)21)20(22,23)24/h2-7,9H,8H2,1H3,(H,31,32)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
chymase


(Mesocricetus auratus (Golden hamster))		BDBM256003
PNG
(US9481672, 181)
Show SMILES Cn1c2ccc(cc2[nH]c1=O)-n1cc(C(O)=O)c(=O)n(Cc2cccc(c2Cl)C(F)(F)F)c1=O
Show InChI InChI=1S/C21H14ClF3N4O5/c1-27-15-6-5-11(7-14(15)26-19(27)33)28-9-12(18(31)32)17(30)29(20(28)34)8-10-3-2-4-13(16(10)22)21(23,24)25/h2-7,9H,8H2,1H3,(H,26,33)(H,31,32)
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Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...

US Patent US9481672 (2016)


BindingDB Entry DOI: 10.7270/Q20P0XZ7
More data for this
Ligand-Target Pair
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