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Patent code US9732085

Compile Data Set for Download or QSAR
Found 36 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
Coagulation factor XI


(Homo sapiens (Human))
BDBM335414
PNG
(4-(2-{(3S)-8-chloro-7-[5-chloro-2-(1H-tetrazol-1-y...)
Show SMILES OC(=O)c1cc(cs1)-c1cnc([nH]1)[C@@H]1CCc2c(Cl)c(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335416
PNG
(5-(2-{(3S)-7-[5-chloro-2-(1H-tetrazol-1-yl)phenyl]...)
Show SMILES OC(=O)c1ccc(s1)-c1[nH]c(nc1F)[C@@H]1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335412
PNG
(4-(2-{(3S)-7-[5-chloro-2-(1H-tetrazol-1-yl)phenyl]...)
Show SMILES OC(=O)c1cc(cs1)-c1cnc([nH]1)[C@@H]1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335399
PNG
((3S)-3-[5-(6-amino-3-pyridinyl)-4-chloro-1H-imidaz...)
Show SMILES Nc1ccc(cn1)-c1[nH]c(nc1Cl)[C@@H]1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335418
PNG
(4-(2-{(3S)-7-[5-chloro-2-(1H-tetrazol-1-yl)phenyl]...)
Show SMILES OC(=O)c1scc(c1F)-c1cnc([nH]1)[C@@H]1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
Show InChI InChI=1S/C23H15ClFN7O3S/c24-12-1-3-17(31-10-27-29-30-31)14(7-12)11-5-13-2-4-18(32(13)19(33)6-11)22-26-8-16(28-22)15-9-36-21(20(15)25)23(34)35/h1,3,5-10,18H,2,4H2,(H,26,28)(H,34,35)/t18-/m0/s1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335413
PNG
(5-(2-{(3S)-8-chloro-7-[5-chloro-2-(1H-tetrazol-1-y...)
Show SMILES OC(=O)c1ccc(s1)-c1cnc([nH]1)[C@@H]1CCc2c(Cl)c(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335419
PNG
(4-(5-{7-[5-chloro-2-(1H-tetrazol-1-yl)phenyl]-5-ox...)
Show SMILES OC(=O)c1cc(cs1)-c1nc(F)c([nH]1)C1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335415
PNG
(4-(2-{(6S)-2-[5-chloro-2-(1H-tetrazol-1-yl)phenyl]...)
Show SMILES OC(=O)c1cc(cs1)-c1cnc([nH]1)[C@@H]1CCc2nc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335393
PNG
(US9732085, 57 | methyl{4-[5-chloro-2-({4-[5-chloro...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1[nH]c(Cn2ccc(cc2=O)-c2cc(Cl)ccc2-n2cnnn2)nc1Cl
Show InChI InChI=1S/C24H18Cl2N8O3/c1-37-24(36)28-17-5-2-14(3-6-17)22-23(26)30-20(29-22)12-33-9-8-15(10-21(33)35)18-11-16(25)4-7-19(18)34-13-27-31-32-34/h2-11,13H,12H2,1H3,(H,28,36)(H,29,30)
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335393
PNG
(US9732085, 57 | methyl{4-[5-chloro-2-({4-[5-chloro...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1[nH]c(Cn2ccc(cc2=O)-c2cc(Cl)ccc2-n2cnnn2)nc1Cl
Show InChI InChI=1S/C24H18Cl2N8O3/c1-37-24(36)28-17-5-2-14(3-6-17)22-23(26)30-20(29-22)12-33-9-8-15(10-21(33)35)18-11-16(25)4-7-19(18)34-13-27-31-32-34/h2-11,13H,12H2,1H3,(H,28,36)(H,29,30)
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335408
PNG
(US9732085, 290 | methyl[4-(2-{(3S)-7-[5-chloro-2-(...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1cnc([nH]1)[C@@H]1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cc(nn1)C#N
Show InChI InChI=1S/C28H21ClN8O3/c1-40-28(39)32-19-5-2-16(3-6-19)23-14-31-27(33-23)25-9-7-21-10-17(11-26(38)37(21)25)22-12-18(29)4-8-24(22)36-15-20(13-30)34-35-36/h2-6,8,10-12,14-15,25H,7,9H2,1H3,(H,31,33)(H,32,39)/t25-/m0/s1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335400
PNG
((3S)-3-[5-(6-amino-2-chloro-3-pyridinyl)-1H-imidaz...)
Show SMILES Nc1ccc(-c2cnc([nH]2)[C@@H]2CCc3cc(cc(=O)n23)-c2cc(Cl)ccc2-n2cnnn2)c(Cl)n1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335420
PNG
(US9732085, Comp Ex 1)
Show SMILES COC(=O)Nc1ccc(cc1)-c1[nH]c(nc1Cl)[C@H](Cc1ccccc1)NC(=O)CCc1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Coagulation factor XI


(Homo sapiens (Human))
BDBM335401
PNG
((3S)-3-[5-(6-amino-2-fluoro-3-pyridinyl)-1H-imidaz...)
Show SMILES Nc1ccc(-c2cnc([nH]2)[C@@H]2CCc3cc(cc(=O)n23)-c2cc(Cl)ccc2-n2cnnn2)c(F)n1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335396
PNG
(6-(2-{7-[5-chloro-2-(1H-tetrazol-1-yl)phenyl]-5-ox...)
Show SMILES Clc1ccc(c(c1)-c1cc2CCC(c3nc(c[nH]3)-c3ccc4NC(=O)CCc4c3)n2c(=O)c1)-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335411
PNG
(5-(2-{(3S)-7-[5-chloro-2-(1H-tetrazol-1-yl)phenyl]...)
Show SMILES OC(=O)c1ccc(s1)-c1cnc([nH]1)[C@@H]1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335397
PNG
(US9732085, 129(2) | isopropyl[4-(2-{7-[5-chloro-2-...)
Show SMILES CC(C)OC(=O)Nc1ccc(cc1)-c1cnc([nH]1)C1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335403
PNG
(US9732085, 241 | methyl[4-(4-chloro-5-{7-[5-chloro...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1nc(Cl)c([nH]1)C1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335410
PNG
(US9732085, 310 | methyl[4-(2-{(3S)-7-[5-chloro-2-(...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1cnc([nH]1)[C@@H]1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cc(Cl)nn1
Show InChI InChI=1S/C27H21Cl2N7O3/c1-39-27(38)31-18-5-2-15(3-6-18)21-13-30-26(32-21)23-9-7-19-10-16(11-25(37)36(19)23)20-12-17(28)4-8-22(20)35-14-24(29)33-34-35/h2-6,8,10-14,23H,7,9H2,1H3,(H,30,32)(H,31,38)/t23-/m0/s1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335407
PNG
(US9732085, 278 | methyl(4-{2-[1-{4-[5-chloro-2-(1H...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1cnc([nH]1)C(Cc1cccnc1)n1ccc(cc1=O)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335405
PNG
(US9732085, 264 | methyl{4-[4-chloro-2-(1-{4-[5-chl...)
Show SMILES COCCC(c1nc(Cl)c([nH]1)-c1ccc(NC(=O)OC)cc1)n1ccc(cc1=O)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335391
PNG
(US9732085, 41 | methyl[4-(2-{2-[5-chloro-2-(1H-tet...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1cnc([nH]1)C1CCc2nc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335391
PNG
(US9732085, 41 | methyl[4-(2-{2-[5-chloro-2-(1H-tet...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1cnc([nH]1)C1CCc2nc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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n/an/a 6.5n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335394
PNG
(US9732085, 60 | methyl{4-[5-chloro-2-(1-{4-[5-chlo...)
Show SMILES CCC(c1nc(c(Cl)[nH]1)-c1ccc(NC(=O)OC)cc1)n1ccc(cc1=O)-c1cc(Cl)ccc1-n1cnnn1
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n/an/a 7.20n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335409
PNG
(US9732085, 309 | methyl[4-(2-{(3S)-7-[5-methyl-2-(...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1cnc([nH]1)[C@@H]1CCc2cc(cc(=O)n12)-c1cc(C)ccc1-n1cnnn1
Show InChI InChI=1S/C27H24N8O3/c1-16-3-9-23(34-15-29-32-33-34)21(11-16)18-12-20-8-10-24(35(20)25(36)13-18)26-28-14-22(31-26)17-4-6-19(7-5-17)30-27(37)38-2/h3-7,9,11-15,24H,8,10H2,1-2H3,(H,28,31)(H,30,37)/t24-/m0/s1
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n/an/a 8.30n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335402
PNG
(US9732085, 230 | methyl[6-(4-chloro-2-{(3S)-7-[5-c...)
Show SMILES COC(=O)Nc1ccc(nc1)-c1[nH]c(nc1Cl)[C@@H]1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
Show InChI InChI=1S/C25H19Cl2N9O3/c1-39-25(38)30-15-3-5-18(28-11-15)22-23(27)32-24(31-22)20-7-4-16-8-13(9-21(37)36(16)20)17-10-14(26)2-6-19(17)35-12-29-33-34-35/h2-3,5-6,8-12,20H,4,7H2,1H3,(H,30,38)(H,31,32)/t20-/m0/s1
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n/an/a 11n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335406
PNG
(US9732085, 270 | methyl[4-(2-{(3R)-7-[5-chloro-2-(...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1cnc([nH]1)[C@@H]1CSc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
Show InChI InChI=1S/C25H19ClN8O3S/c1-37-25(36)29-17-5-2-14(3-6-17)19-11-27-24(30-19)21-12-38-23-9-15(8-22(35)34(21)23)18-10-16(26)4-7-20(18)33-13-28-31-32-33/h2-11,13,21H,12H2,1H3,(H,27,30)(H,29,36)/t21-/m0/s1
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n/an/a 11n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335417
PNG
(4-[2-({4-[5-chloro-2-(1H-tetrazol-1-yl)phenyl]-6-m...)
Show SMILES Cc1cc(cc(=O)n1Cc1ncc([nH]1)-c1csc(c1)C(O)=O)-c1cc(Cl)ccc1-n1cnnn1
Show InChI InChI=1S/C22H16ClN7O3S/c1-12-4-13(16-7-15(23)2-3-18(16)30-11-25-27-28-30)6-21(31)29(12)9-20-24-8-17(26-20)14-5-19(22(32)33)34-10-14/h2-8,10-11H,9H2,1H3,(H,24,26)(H,32,33)
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n/an/a 13n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335395
PNG
(US9732085, 61 | methyl{4-[2-(1-{4-[5-chloro-2-(1H-...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1cnc([nH]1)C(C)n1ccc(cc1=O)-c1cc(Cl)ccc1-n1cnnn1
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n/an/a 14n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335392
PNG
(US9732085, 45)
Show SMILES COC(=O)Nc1ccc(cc1)-c1[nH]c(nc1Cl)C1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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n/an/a 15n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335392
PNG
(US9732085, 45)
Show SMILES COC(=O)Nc1ccc(cc1)-c1[nH]c(nc1Cl)C1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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n/an/a 15n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335404
PNG
(US9732085, 245 | methyl[4-(5-{7-[5-chloro-2-(1H-te...)
Show SMILES COC(=O)Nc1ccc(cc1)-c1nnc([nH]1)C1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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n/an/a 17n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335421
PNG
(US9732085, Comp Ex 2)
Show SMILES COC(=O)Nc1ccc(cc1)-c1[nH]c(nc1Cl)[C@H](C)NC(=O)\C=C\c1cc(Cl)ccc1-n1cnnn1
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n/an/a 40n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335398
PNG
(US9732085, 181 | methyl[5-(2-{7-[5-chloro-2-(1H-te...)
Show SMILES COC(=O)Nc1ccc(s1)-c1cnc([nH]1)C1CCc2cc(cc(=O)n12)-c1cc(Cl)ccc1-n1cnnn1
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n/an/a 47n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335422
PNG
(US9732085, Comp Ex 3)
Show SMILES COC(=O)Nc1ccc(cc1)-c1[nH]c(CNC(=O)\C=C\c2cc(Cl)ccc2-n2cnnn2)nc1Cl
Show InChI InChI=1S/C22H18Cl2N8O3/c1-35-22(34)27-16-6-2-13(3-7-16)20-21(24)29-18(28-20)11-25-19(33)9-4-14-10-15(23)5-8-17(14)32-12-26-30-31-32/h2-10,12H,11H2,1H3,(H,25,33)(H,27,34)(H,28,29)/b9-4+
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n/an/a 130n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM335423
PNG
(US9732085, Comp. Ex 4)
Show SMILES COc1cc(Nc2ccc3CCCC(c4ccc(F)cc4)n3c2=O)ccc1-n1cnc(C)c1
Show InChI InChI=1S/C26H25FN4O2/c1-17-15-30(16-28-17)24-13-10-20(14-25(24)33-2)29-22-12-11-21-4-3-5-23(31(21)26(22)32)18-6-8-19(27)9-7-18/h6-16,23,29H,3-5H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Ono Pharmaceutical Co., Ltd

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9732085 (2017)


BindingDB Entry DOI: 10.7270/Q25X2C2P
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%