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Patent code US10633375

Compile Data Set for Download or QSAR
Found 111 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))
BDBM439415
PNG
((S)-4-(4-(tert-butoxy)-2-(4-(5-chloro-2-propionylp...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)[C@@H](CCOC(C)(C)C)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C30H33ClN2O7/c1-6-25(34)21-12-9-19(31)15-22(21)23-16-27(35)33(17-26(23)39-5)24(13-14-40-30(2,3)4)28(36)32-20-10-7-18(8-11-20)29(37)38/h7-12,15-17,24H,6,13-14H2,1-5H3,(H,32,36)(H,37,38)/t24-/m0/s1
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n/an/a 12n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439331
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2ccccc2)C(=O)Nc2ccc(cc2)C(N)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H26ClN3O5/c1-18(35)23-13-10-21(31)15-24(23)25-16-28(36)34(17-27(25)39-2)26(14-19-6-4-3-5-7-19)30(38)33-22-11-8-20(9-12-22)29(32)37/h3-13,15-17,26H,14H2,1-2H3,(H2,32,37)(H,33,38)/t26-/m0/s1
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n/an/a 13n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439330
PNG
((S)-4-(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)[C@@H](Cc1ccccc1)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C31H27ClN2O6/c1-3-27(35)23-14-11-21(32)16-24(23)25-17-29(36)34(18-28(25)40-2)26(15-19-7-5-4-6-8-19)30(37)33-22-12-9-20(10-13-22)31(38)39/h4-14,16-18,26H,3,15H2,1-2H3,(H,33,37)(H,38,39)/t26-/m0/s1
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n/an/a 14n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439325
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2ccccc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H25ClN2O6/c1-18(34)23-13-10-21(31)15-24(23)25-16-28(35)33(17-27(25)39-2)26(14-19-6-4-3-5-7-19)29(36)32-22-11-8-20(9-12-22)30(37)38/h3-13,15-17,26H,14H2,1-2H3,(H,32,36)(H,37,38)/t26-/m0/s1
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n/an/a 16n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439328
PNG
(4-(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy-2-o...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(Cc1ccccc1)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C31H27ClN2O6/c1-3-27(35)23-14-11-21(32)16-24(23)25-17-29(36)34(18-28(25)40-2)26(15-19-7-5-4-6-8-19)30(37)33-22-12-9-20(10-13-22)31(38)39/h4-14,16-18,26H,3,15H2,1-2H3,(H,33,37)(H,38,39)
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n/an/a 17n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439418
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](CCOC(C)(C)C)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H31ClN2O7/c1-17(33)21-11-8-19(30)14-22(21)23-15-26(34)32(16-25(23)38-5)24(12-13-39-29(2,3)4)27(35)31-20-9-6-18(7-10-20)28(36)37/h6-11,14-16,24H,12-13H2,1-5H3,(H,31,35)(H,36,37)/t24-/m0/s1
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n/an/a 18n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439322
PNG
((S)-5-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COCC[C@@H](C(=O)Nc1ccc2[nH]c(cc2c1)C(O)=O)n1cc(OC)c(cc1=O)-c1cc(Cl)ccc1C(C)=O
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n/an/a 19n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439396
PNG
((S)-4-(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)[C@@H](Cc1ccn(n1)C1CC1)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C31H29ClN4O6/c1-3-27(37)23-11-6-19(32)14-24(23)25-16-29(38)35(17-28(25)42-2)26(15-21-12-13-36(34-21)22-9-10-22)30(39)33-20-7-4-18(5-8-20)31(40)41/h4-8,11-14,16-17,22,26H,3,9-10,15H2,1-2H3,(H,33,39)(H,40,41)/t26-/m0/s1
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n/an/a 21n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439373
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cccc(C[C@@H](C(=O)Nc2ccc(cc2)C(O)=O)n2cc(OC)c(cc2=O)-c2cc(Cl)ccc2C(C)=O)c1
Show InChI InChI=1S/C31H27ClN2O7/c1-18(35)24-12-9-21(32)15-25(24)26-16-29(36)34(17-28(26)41-3)27(14-19-5-4-6-23(13-19)40-2)30(37)33-22-10-7-20(8-11-22)31(38)39/h4-13,15-17,27H,14H2,1-3H3,(H,33,37)(H,38,39)/t27-/m0/s1
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n/an/a 21n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439344
PNG
((S)-4-(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)[C@@H](Cc1ccccc1)C(=O)Nc1ccc(cc1)C(N)=O
Show InChI InChI=1S/C31H28ClN3O5/c1-3-27(36)23-14-11-21(32)16-24(23)25-17-29(37)35(18-28(25)40-2)26(15-19-7-5-4-6-8-19)31(39)34-22-12-9-20(10-13-22)30(33)38/h4-14,16-18,26H,3,15H2,1-2H3,(H2,33,38)(H,34,39)/t26-/m0/s1
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n/an/a 21n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439408
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2ccn(C)n2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H25ClN4O6/c1-16(34)21-9-6-18(29)12-22(21)23-14-26(35)33(15-25(23)39-3)24(13-20-10-11-32(2)31-20)27(36)30-19-7-4-17(5-8-19)28(37)38/h4-12,14-15,24H,13H2,1-3H3,(H,30,36)(H,37,38)/t24-/m0/s1
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n/an/a 23n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439398
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2ccn(n2)C2CC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H27ClN4O6/c1-17(36)23-10-5-19(31)13-24(23)25-15-28(37)34(16-27(25)41-2)26(14-21-11-12-35(33-21)22-8-9-22)29(38)32-20-6-3-18(4-7-20)30(39)40/h3-7,10-13,15-16,22,26H,8-9,14H2,1-2H3,(H,32,38)(H,39,40)/t26-/m0/s1
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n/an/a 24n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439340
PNG
(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy-2-oxop...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(Cc1ccccc1)C(=O)Nc1ccc2ncncc2c1
Show InChI InChI=1S/C32H27ClN4O4/c1-3-29(38)24-11-9-22(33)15-25(24)26-16-31(39)37(18-30(26)41-2)28(13-20-7-5-4-6-8-20)32(40)36-23-10-12-27-21(14-23)17-34-19-35-27/h4-12,14-19,28H,3,13H2,1-2H3,(H,36,40)
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n/an/a 24n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439415
PNG
((S)-4-(4-(tert-butoxy)-2-(4-(5-chloro-2-propionylp...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)[C@@H](CCOC(C)(C)C)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C30H33ClN2O7/c1-6-25(34)21-12-9-19(31)15-22(21)23-16-27(35)33(17-26(23)39-5)24(13-14-40-30(2,3)4)28(36)32-20-10-7-18(8-11-20)29(37)38/h7-12,15-17,24H,6,13-14H2,1-5H3,(H,32,36)(H,37,38)/t24-/m0/s1
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n/an/a 27n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439421
PNG
((S)-4-(tert-butoxy)-2-(4-(5-chloro-2-propionylphen...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)[C@@H](CCOC(C)(C)C)C(=O)Nc1ccc2nccnc2c1
Show InChI InChI=1S/C31H33ClN4O5/c1-6-27(37)21-9-7-19(32)15-22(21)23-17-29(38)36(18-28(23)40-5)26(11-14-41-31(2,3)4)30(39)35-20-8-10-24-25(16-20)34-13-12-33-24/h7-10,12-13,15-18,26H,6,11,14H2,1-5H3,(H,35,39)/t26-/m0/s1
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n/an/a 27n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439349
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES CCNC(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)n2cc(OC)c(cc2=O)-c2cc(Cl)ccc2C(C)=O)cc1
Show InChI InChI=1S/C32H30ClN3O5/c1-4-34-31(39)22-10-13-24(14-11-22)35-32(40)28(16-21-8-6-5-7-9-21)36-19-29(41-3)27(18-30(36)38)26-17-23(33)12-15-25(26)20(2)37/h5-15,17-19,28H,4,16H2,1-3H3,(H,34,39)(H,35,40)/t28-/m0/s1
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n/an/a 29n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439405
PNG
(4-(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy-2-o...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(Cc1ccn(C)n1)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C29H27ClN4O6/c1-4-25(35)21-10-7-18(30)13-22(21)23-15-27(36)34(16-26(23)40-3)24(14-20-11-12-33(2)32-20)28(37)31-19-8-5-17(6-9-19)29(38)39/h5-13,15-16,24H,4,14H2,1-3H3,(H,31,37)(H,38,39)
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n/an/a 29n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439414
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2cnn(C)c2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H25ClN4O6/c1-16(34)21-9-6-19(29)11-22(21)23-12-26(35)33(15-25(23)39-3)24(10-17-13-30-32(2)14-17)27(36)31-20-7-4-18(5-8-20)28(37)38/h4-9,11-15,24H,10H2,1-3H3,(H,31,36)(H,37,38)/t24-/m0/s1
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n/an/a 30n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439447
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](CCOC2CCC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H29ClN2O7/c1-17(33)22-11-8-19(30)14-23(22)24-15-27(34)32(16-26(24)38-2)25(12-13-39-21-4-3-5-21)28(35)31-20-9-6-18(7-10-20)29(36)37/h6-11,14-16,21,25H,3-5,12-13H2,1-2H3,(H,31,35)(H,36,37)/t25-/m0/s1
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n/an/a 30n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439350
PNG
(N-(1H-benzo[d]imidazol-5-yl)-2-(4-(5-chloro-2-prop...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(Cc1ccccc1)C(=O)Nc1ccc2[nH]cnc2c1
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n/an/a 30n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439325
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2ccccc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H25ClN2O6/c1-18(34)23-13-10-21(31)15-24(23)25-16-28(35)33(17-27(25)39-2)26(14-19-6-4-3-5-7-19)29(36)32-22-11-8-20(9-12-22)30(37)38/h3-13,15-17,26H,14H2,1-2H3,(H,32,36)(H,37,38)/t26-/m0/s1
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n/an/a 31n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439401
PNG
(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxopyri...)
Show SMILES COc1cn(C(Cc2ccn(n2)C2CC2)C(=O)Nc2ccc3nccnc3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H27ClN6O4/c1-18(39)23-7-3-19(32)13-24(23)25-16-30(40)37(17-29(25)42-2)28(15-21-9-12-38(36-21)22-5-6-22)31(41)35-20-4-8-26-27(14-20)34-11-10-33-26/h3-4,7-14,16-17,22,28H,5-6,15H2,1-2H3,(H,35,41)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439438
PNG
(4-(2-(4-(6-acetyl-3-chloro-2-fluorophenyl)-5-metho...)
Show SMILES COc1cn(C(CC2CCC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1c(F)c(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H26ClFN2O6/c1-15(33)19-10-11-21(29)26(30)25(19)20-13-24(34)32(14-23(20)38-2)22(12-16-4-3-5-16)27(35)31-18-8-6-17(7-9-18)28(36)37/h6-11,13-14,16,22H,3-5,12H2,1-2H3,(H,31,35)(H,36,37)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439420
PNG
(4-(tert-butoxy)-2-(4-(5-chloro-2-propionylphenyl)-...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(CCOC(C)(C)C)C(=O)Nc1ccc2nccnc2c1
Show InChI InChI=1S/C31H33ClN4O5/c1-6-27(37)21-9-7-19(32)15-22(21)23-17-29(38)36(18-28(23)40-5)26(11-14-41-31(2,3)4)30(39)35-20-8-10-24-25(16-20)34-13-12-33-24/h7-10,12-13,15-18,26H,6,11,14H2,1-5H3,(H,35,39)
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n/an/a 33n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439327
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccsc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H23ClN2O6S/c1-16(32)21-8-5-19(29)12-22(21)23-13-26(33)31(14-25(23)37-2)24(11-17-9-10-38-15-17)27(34)30-20-6-3-18(4-7-20)28(35)36/h3-10,12-15,24H,11H2,1-2H3,(H,30,34)(H,35,36)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439321
PNG
(5-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COCCC(C(=O)Nc1ccc2[nH]c(cc2c1)C(O)=O)n1cc(OC)c(cc1=O)-c1cc(Cl)ccc1C(C)=O
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439364
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccccc2C)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H27ClN2O6/c1-18-6-4-5-7-21(18)14-27(30(37)33-23-11-8-20(9-12-23)31(38)39)34-17-28(40-3)26(16-29(34)36)25-15-22(32)10-13-24(25)19(2)35/h4-13,15-17,27H,14H2,1-3H3,(H,33,37)(H,38,39)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439365
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2cccc(C)c2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H27ClN2O6/c1-18-5-4-6-20(13-18)14-27(30(37)33-23-10-7-21(8-11-23)31(38)39)34-17-28(40-3)26(16-29(34)36)25-15-22(32)9-12-24(25)19(2)35/h4-13,15-17,27H,14H2,1-3H3,(H,33,37)(H,38,39)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439406
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccn(C)n2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H25ClN4O6/c1-16(34)21-9-6-18(29)12-22(21)23-14-26(35)33(15-25(23)39-3)24(13-20-10-11-32(2)31-20)27(36)30-19-7-4-17(5-8-19)28(37)38/h4-12,14-15,24H,13H2,1-3H3,(H,30,36)(H,37,38)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439451
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](CC2CCC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H27ClN2O6/c1-16(32)21-11-8-19(29)13-22(21)23-14-26(33)31(15-25(23)37-2)24(12-17-4-3-5-17)27(34)30-20-9-6-18(7-10-20)28(35)36/h6-11,13-15,17,24H,3-5,12H2,1-2H3,(H,30,34)(H,35,36)/t24-/m0/s1
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439444
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(CCOC2CCC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H29ClN2O7/c1-17(33)22-11-8-19(30)14-23(22)24-15-27(34)32(16-26(24)38-2)25(12-13-39-21-4-3-5-21)28(35)31-20-9-6-18(7-10-20)29(36)37/h6-11,14-16,21,25H,3-5,12-13H2,1-2H3,(H,31,35)(H,36,37)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439339
PNG
(4-(2-(4-(2-butyryl-5-chlorophenyl)-5-methoxy-2-oxo...)
Show SMILES CCCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(Cc1ccccc1)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C32H29ClN2O6/c1-3-7-28(36)24-15-12-22(33)17-25(24)26-18-30(37)35(19-29(26)41-2)27(16-20-8-5-4-6-9-20)31(38)34-23-13-10-21(11-14-23)32(39)40/h4-6,8-15,17-19,27H,3,7,16H2,1-2H3,(H,34,38)(H,39,40)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439341
PNG
(4-(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy-2-o...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(Cc1ccccc1)C(=O)Nc1ccc(cc1)C(N)=O
Show InChI InChI=1S/C31H28ClN3O5/c1-3-27(36)23-14-11-21(32)16-24(23)25-17-29(37)35(18-28(25)40-2)26(15-19-7-5-4-6-8-19)31(39)34-22-12-9-20(10-13-22)30(33)38/h4-14,16-18,26H,3,15H2,1-2H3,(H2,33,38)(H,34,39)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439403
PNG
(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxopyri...)
Show SMILES COc1cn(C(Cc2ccn(n2)C2CC2)C(=O)Nc2ccc3nn(C)cc3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H29ClN6O4/c1-18(39)24-8-4-20(32)13-25(24)26-15-30(40)37(17-29(26)42-3)28(14-22-10-11-38(34-22)23-6-7-23)31(41)33-21-5-9-27-19(12-21)16-36(2)35-27/h4-5,8-13,15-17,23,28H,6-7,14H2,1-3H3,(H,33,41)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439338
PNG
((S)-2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxo...)
Show SMILES COc1cn([C@@H](Cc2ccccc2)C(=O)Nc2ccc3nn(C)cc3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H27ClN4O4/c1-19(37)24-11-9-22(32)15-25(24)26-16-30(38)36(18-29(26)40-3)28(13-20-7-5-4-6-8-20)31(39)33-23-10-12-27-21(14-23)17-35(2)34-27/h4-12,14-18,28H,13H2,1-3H3,(H,33,39)/t28-/m0/s1
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439432
PNG
(4-(2-(4-(6-acetyl-3-chloro-2-fluorophenyl)-5-metho...)
Show SMILES COCCC(C(=O)Nc1ccc(cc1)C(O)=O)n1cc(OC)c(cc1=O)-c1c(F)c(Cl)ccc1C(C)=O
Show InChI InChI=1S/C26H24ClFN2O7/c1-14(31)17-8-9-19(27)24(28)23(17)18-12-22(32)30(13-21(18)37-3)20(10-11-36-2)25(33)29-16-6-4-15(5-7-16)26(34)35/h4-9,12-13,20H,10-11H2,1-3H3,(H,29,33)(H,34,35)
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Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439352
PNG
(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxopyri...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc3ncncc3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H25ClN4O4/c1-19(37)24-10-8-22(32)14-25(24)26-15-30(38)36(17-29(26)40-2)28(12-20-6-4-3-5-7-20)31(39)35-23-9-11-27-21(13-23)16-33-18-34-27/h3-11,13-18,28H,12H2,1-2H3,(H,35,39)
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n/an/a 38n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439351
PNG
(4-(2-(4-(5-chloro-2-(2-cyclopropylacetyl)phenyl)-5...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(=O)CC1CC1
Show InChI InChI=1S/C33H29ClN2O6/c1-42-30-19-36(31(38)18-27(30)26-17-23(34)11-14-25(26)29(37)16-21-7-8-21)28(15-20-5-3-2-4-6-20)32(39)35-24-12-9-22(10-13-24)33(40)41/h2-6,9-14,17-19,21,28H,7-8,15-16H2,1H3,(H,35,39)(H,40,41)
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n/an/a 38n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439324
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H25ClN2O6/c1-18(34)23-13-10-21(31)15-24(23)25-16-28(35)33(17-27(25)39-2)26(14-19-6-4-3-5-7-19)29(36)32-22-11-8-20(9-12-22)30(37)38/h3-13,15-17,26H,14H2,1-2H3,(H,32,36)(H,37,38)
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n/an/a 39n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439353
PNG
(4-(2-(4-(5-chloro-2-(cyclopropanecarbonyl)phenyl)-...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(=O)C1CC1
Show InChI InChI=1S/C32H27ClN2O6/c1-41-28-18-35(29(36)17-26(28)25-16-22(33)11-14-24(25)30(37)20-7-8-20)27(15-19-5-3-2-4-6-19)31(38)34-23-12-9-21(10-13-23)32(39)40/h2-6,9-14,16-18,20,27H,7-8,15H2,1H3,(H,34,38)(H,39,40)
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n/an/a 39n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439380
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2ccccn2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H24ClN3O6/c1-17(34)22-11-8-19(30)13-23(22)24-15-27(35)33(16-26(24)39-2)25(14-21-5-3-4-12-31-21)28(36)32-20-9-6-18(7-10-20)29(37)38/h3-13,15-16,25H,14H2,1-2H3,(H,32,36)(H,37,38)/t25-/m0/s1
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n/an/a 40n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439404
PNG
(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxopyri...)
Show SMILES COc1cn(C(Cc2ccn(n2)C2CC2)C(=O)Nc2ccc3ncncc3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H27ClN6O4/c1-18(39)24-7-3-20(32)12-25(24)26-14-30(40)37(16-29(26)42-2)28(13-22-9-10-38(36-22)23-5-6-23)31(41)35-21-4-8-27-19(11-21)15-33-17-34-27/h3-4,7-12,14-17,23,28H,5-6,13H2,1-2H3,(H,35,41)
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n/an/a 40n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439354
PNG
(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxopyri...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc3cn[nH]c3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
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n/an/a 40n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439332
PNG
(US10633375, Compound No. 12 | methyl (S)-(4-(2-(4-...)
Show SMILES COC(=O)Nc1ccc(NC(=O)[C@H](Cc2ccccc2)n2cc(OC)c(cc2=O)-c2cc(Cl)ccc2C(C)=O)cc1
Show InChI InChI=1S/C31H28ClN3O6/c1-19(36)24-14-9-21(32)16-25(24)26-17-29(37)35(18-28(26)40-2)27(15-20-7-5-4-6-8-20)30(38)33-22-10-12-23(13-11-22)34-31(39)41-3/h4-14,16-18,27H,15H2,1-3H3,(H,33,38)(H,34,39)/t27-/m0/s1
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n/an/a 42n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439448
PNG
(4-(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy-2-o...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(CC1CCCCO1)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C30H31ClN2O7/c1-3-26(34)22-12-9-19(31)14-23(22)24-16-28(35)33(17-27(24)39-2)25(15-21-6-4-5-13-40-21)29(36)32-20-10-7-18(8-11-20)30(37)38/h7-12,14,16-17,21,25H,3-6,13,15H2,1-2H3,(H,32,36)(H,37,38)
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n/an/a 42n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439393
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2cccc(c2)C#N)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H24ClN3O6/c1-18(36)24-11-8-22(32)14-25(24)26-15-29(37)35(17-28(26)41-2)27(13-19-4-3-5-20(12-19)16-33)30(38)34-23-9-6-21(7-10-23)31(39)40/h3-12,14-15,17,27H,13H2,1-2H3,(H,34,38)(H,39,40)/t27-/m0/s1
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n/an/a 42n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439384
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2cccnc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H24ClN3O6/c1-17(34)22-10-7-20(30)13-23(22)24-14-27(35)33(16-26(24)39-2)25(12-18-4-3-11-31-15-18)28(36)32-21-8-5-19(6-9-21)29(37)38/h3-11,13-16,25H,12H2,1-2H3,(H,32,36)(H,37,38)/t25-/m0/s1
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n/an/a 42n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439397
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccn(n2)C2CC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H27ClN4O6/c1-17(36)23-10-5-19(31)13-24(23)25-15-28(37)34(16-27(25)41-2)26(14-21-11-12-35(33-21)22-8-9-22)29(38)32-20-6-3-18(4-7-20)30(39)40/h3-7,10-13,15-16,22,26H,8-9,14H2,1-2H3,(H,32,38)(H,39,40)
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n/an/a 42n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439363
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccc(F)cc2F)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H23ClF2N2O6/c1-16(36)22-10-6-19(31)12-23(22)24-14-28(37)35(15-27(24)41-2)26(11-18-3-7-20(32)13-25(18)33)29(38)34-21-8-4-17(5-9-21)30(39)40/h3-10,12-15,26H,11H2,1-2H3,(H,34,38)(H,39,40)
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n/an/a 43n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439450
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](CC2CC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C27H25ClN2O6/c1-15(31)20-10-7-18(28)12-21(20)22-13-25(32)30(14-24(22)36-2)23(11-16-3-4-16)26(33)29-19-8-5-17(6-9-19)27(34)35/h5-10,12-14,16,23H,3-4,11H2,1-2H3,(H,29,33)(H,34,35)/t23-/m0/s1
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n/an/a 43n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439424
PNG
(5-(4-(tert-butoxy)-2-(4-(5-chloro-2-propionylpheny...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(CCOC(C)(C)C)C(=O)Nc1ccc2[nH]c(cc2c1)C(O)=O
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n/an/a 45n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439379
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccccn2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H24ClN3O6/c1-17(34)22-11-8-19(30)13-23(22)24-15-27(35)33(16-26(24)39-2)25(14-21-5-3-4-12-31-21)28(36)32-20-9-6-18(7-10-20)29(37)38/h3-13,15-16,25H,14H2,1-2H3,(H,32,36)(H,37,38)
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n/an/a 45n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439333
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES CNC(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)n2cc(OC)c(cc2=O)-c2cc(Cl)ccc2C(C)=O)cc1
Show InChI InChI=1S/C31H28ClN3O5/c1-19(36)24-14-11-22(32)16-25(24)26-17-29(37)35(18-28(26)40-3)27(15-20-7-5-4-6-8-20)31(39)34-23-12-9-21(10-13-23)30(38)33-2/h4-14,16-18,27H,15H2,1-3H3,(H,33,38)(H,34,39)/t27-/m0/s1
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n/an/a 46n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439437
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(CC2(C)CC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H27ClN2O6/c1-16(32)20-9-6-18(29)12-21(20)22-13-25(33)31(15-24(22)37-3)23(14-28(2)10-11-28)26(34)30-19-7-4-17(5-8-19)27(35)36/h4-9,12-13,15,23H,10-11,14H2,1-3H3,(H,30,34)(H,35,36)
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n/an/a 46n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439371
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cccc(CC(C(=O)Nc2ccc(cc2)C(O)=O)n2cc(OC)c(cc2=O)-c2cc(Cl)ccc2C(C)=O)c1
Show InChI InChI=1S/C31H27ClN2O7/c1-18(35)24-12-9-21(32)15-25(24)26-16-29(36)34(17-28(26)41-3)27(14-19-5-4-6-23(13-19)40-2)30(37)33-22-10-7-20(8-11-22)31(38)39/h4-13,15-17,27H,14H2,1-3H3,(H,33,37)(H,38,39)
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n/an/a 46n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439355
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2ccccc2)C(=O)Nc2ccc(cc2)C(=O)NC2CC2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C33H30ClN3O5/c1-20(38)26-15-10-23(34)17-27(26)28-18-31(39)37(19-30(28)42-2)29(16-21-6-4-3-5-7-21)33(41)36-24-11-8-22(9-12-24)32(40)35-25-13-14-25/h3-12,15,17-19,25,29H,13-14,16H2,1-2H3,(H,35,40)(H,36,41)/t29-/m0/s1
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n/an/a 47n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439368
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccccc2F)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H24ClFN2O6/c1-17(35)22-12-9-20(31)14-23(22)24-15-28(36)34(16-27(24)40-2)26(13-19-5-3-4-6-25(19)32)29(37)33-21-10-7-18(8-11-21)30(38)39/h3-12,14-16,26H,13H2,1-2H3,(H,33,37)(H,38,39)
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n/an/a 47n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439369
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccc(Cl)cc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H24Cl2N2O6/c1-17(35)23-12-9-21(32)14-24(23)25-15-28(36)34(16-27(25)40-2)26(13-18-3-7-20(31)8-4-18)29(37)33-22-10-5-19(6-11-22)30(38)39/h3-12,14-16,26H,13H2,1-2H3,(H,33,37)(H,38,39)
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n/an/a 49n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439425
PNG
(4-(2-(4-(6-acetyl-3-chloro-2-fluorophenyl)-5-metho...)
Show SMILES COc1cn(C(CCOC(C)(C)C)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1c(F)c(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H30ClFN2O7/c1-16(34)19-10-11-21(30)26(31)25(19)20-14-24(35)33(15-23(20)39-5)22(12-13-40-29(2,3)4)27(36)32-18-8-6-17(7-9-18)28(37)38/h6-11,14-15,22H,12-13H2,1-5H3,(H,32,36)(H,37,38)
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n/an/a 49n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439395
PNG
(4-(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy-2-o...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(Cc1ccn(n1)C1CC1)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C31H29ClN4O6/c1-3-27(37)23-11-6-19(32)14-24(23)25-16-29(38)35(17-28(25)42-2)26(15-21-12-13-36(34-21)22-9-10-22)30(39)33-20-7-4-18(5-8-20)31(40)41/h4-8,11-14,16-17,22,26H,3,9-10,15H2,1-2H3,(H,33,39)(H,40,41)
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n/an/a 50n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439417
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(CCOC(C)(C)C)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H31ClN2O7/c1-17(33)21-11-8-19(30)14-22(21)23-15-26(34)32(16-25(23)38-5)24(12-13-39-29(2,3)4)27(35)31-20-9-6-18(7-10-20)28(36)37/h6-11,14-16,24H,12-13H2,1-5H3,(H,31,35)(H,36,37)
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n/an/a 53n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439356
PNG
(4-(2-(4-(5-chloro-2-isobutyrylphenyl)-5-methoxy-2-...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(=O)C(C)C
Show InChI InChI=1S/C32H29ClN2O6/c1-19(2)30(37)24-14-11-22(33)16-25(24)26-17-29(36)35(18-28(26)41-3)27(15-20-7-5-4-6-8-20)31(38)34-23-12-9-21(10-13-23)32(39)40/h4-14,16-19,27H,15H2,1-3H3,(H,34,38)(H,39,40)
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n/an/a 53n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439370
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccccc2Cl)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H24Cl2N2O6/c1-17(35)22-12-9-20(31)14-23(22)24-15-28(36)34(16-27(24)40-2)26(13-19-5-3-4-6-25(19)32)29(37)33-21-10-7-18(8-11-21)30(38)39/h3-12,14-16,26H,13H2,1-2H3,(H,33,37)(H,38,39)
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n/an/a 54n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439361
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccc(F)cc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H24ClFN2O6/c1-17(35)23-12-7-20(31)14-24(23)25-15-28(36)34(16-27(25)40-2)26(13-18-3-8-21(32)9-4-18)29(37)33-22-10-5-19(6-11-22)30(38)39/h3-12,14-16,26H,13H2,1-2H3,(H,33,37)(H,38,39)
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n/an/a 55n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439434
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COCCC(C(=O)Nc1ccc(cc1)C(O)=O)n1cc(OC)c(cc1=O)-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C26H25ClN2O7/c1-15(30)19-9-6-17(27)12-20(19)21-13-24(31)29(14-23(21)36-3)22(10-11-35-2)25(32)28-18-7-4-16(5-8-18)26(33)34/h4-9,12-14,22H,10-11H2,1-3H3,(H,28,32)(H,33,34)
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n/an/a 56n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439336
PNG
(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxopyri...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc3nn(C)cc3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H27ClN4O4/c1-19(37)24-11-9-22(32)15-25(24)26-16-30(38)36(18-29(26)40-3)28(13-20-7-5-4-6-8-20)31(39)33-23-10-12-27-21(14-23)17-35(2)34-27/h4-12,14-18,28H,13H2,1-3H3,(H,33,39)
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n/an/a 56n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439362
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccccc2Br)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H24BrClN2O6/c1-17(35)22-12-9-20(32)14-23(22)24-15-28(36)34(16-27(24)40-2)26(13-19-5-3-4-6-25(19)31)29(37)33-21-10-7-18(8-11-21)30(38)39/h3-12,14-16,26H,13H2,1-2H3,(H,33,37)(H,38,39)
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n/an/a 58n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439431
PNG
(4-(tert-butoxy)-2-(4-(5-chloro-2-propionylphenyl)-...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(CCOC(C)(C)C)C(=O)Nc1ccc2nn(C)cc2c1
Show InChI InChI=1S/C31H35ClN4O5/c1-7-27(37)22-10-8-20(32)15-23(22)24-16-29(38)36(18-28(24)40-6)26(12-13-41-31(2,3)4)30(39)33-21-9-11-25-19(14-21)17-35(5)34-25/h8-11,14-18,26H,7,12-13H2,1-6H3,(H,33,39)
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n/an/a 66n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439346
PNG
(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy-2-oxop...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(Cc1ccccc1)C(=O)Nc1ccc2cn[nH]c2c1
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n/an/a 66n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439427
PNG
(4-(tert-butoxy)-2-(4-(5-chloro-2-propionylphenyl)-...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(CCOC(C)(C)C)C(=O)Nc1ccc2ncncc2c1
Show InChI InChI=1S/C31H33ClN4O5/c1-6-27(37)22-9-7-20(32)14-23(22)24-15-29(38)36(17-28(24)40-5)26(11-12-41-31(2,3)4)30(39)35-21-8-10-25-19(13-21)16-33-18-34-25/h7-10,13-18,26H,6,11-12H2,1-5H3,(H,35,39)
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n/an/a 67n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439442
PNG
((R)-4-(2-(4-(6-acetyl-3-chloro-2-fluorophenyl)-5-m...)
Show SMILES COc1cn([C@H](CC2CCC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1c(F)c(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H26ClFN2O6/c1-15(33)19-10-11-21(29)26(30)25(19)20-13-24(34)32(14-23(20)38-2)22(12-16-4-3-5-16)27(35)31-18-8-6-17(7-9-18)28(36)37/h6-11,13-14,16,22H,3-5,12H2,1-2H3,(H,31,35)(H,36,37)/t22-/m1/s1
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n/an/a 68n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439382
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2cccnc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H24ClN3O6/c1-17(34)22-10-7-20(30)13-23(22)24-14-27(35)33(16-26(24)39-2)25(12-18-4-3-11-31-15-18)28(36)32-21-8-5-19(6-9-21)29(37)38/h3-11,13-16,25H,12H2,1-2H3,(H,32,36)(H,37,38)
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n/an/a 68n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439357
PNG
(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxopyri...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc3nccnc3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H25ClN4O4/c1-19(37)23-10-8-21(32)15-24(23)25-17-30(38)36(18-29(25)40-2)28(14-20-6-4-3-5-7-20)31(39)35-22-9-11-26-27(16-22)34-13-12-33-26/h3-13,15-18,28H,14H2,1-2H3,(H,35,39)
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n/an/a 69n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439411
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2cnn(C)c2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H25ClN4O6/c1-16(34)21-9-6-19(29)11-22(21)23-12-26(35)33(15-25(23)39-3)24(10-17-13-30-32(2)14-17)27(36)31-20-7-4-18(5-8-20)28(37)38/h4-9,11-15,24H,10H2,1-3H3,(H,31,36)(H,37,38)
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n/an/a 70n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439454
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(CC2CCCCO2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H29ClN2O7/c1-17(33)22-11-8-19(30)13-23(22)24-15-27(34)32(16-26(24)38-2)25(14-21-5-3-4-12-39-21)28(35)31-20-9-6-18(7-10-20)29(36)37/h6-11,13,15-16,21,25H,3-5,12,14H2,1-2H3,(H,31,35)(H,36,37)
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n/an/a 71n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439359
PNG
(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxopyri...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc3cnccc3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C32H26ClN3O4/c1-20(37)26-11-9-24(33)16-27(26)28-17-31(38)36(19-30(28)40-2)29(14-21-6-4-3-5-7-21)32(39)35-25-10-8-23-18-34-13-12-22(23)15-25/h3-13,15-19,29H,14H2,1-2H3,(H,35,39)
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n/an/a 71n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439377
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1ccccc1CC(C(=O)Nc1ccc(cc1)C(O)=O)n1cc(OC)c(cc1=O)-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H27ClN2O7/c1-18(35)23-13-10-21(32)15-24(23)25-16-29(36)34(17-28(25)41-3)26(14-20-6-4-5-7-27(20)40-2)30(37)33-22-11-8-19(9-12-22)31(38)39/h4-13,15-17,26H,14H2,1-3H3,(H,33,37)(H,38,39)
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n/an/a 72n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439391
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccccc2C#N)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H24ClN3O6/c1-18(36)24-12-9-22(32)14-25(24)26-15-29(37)35(17-28(26)41-2)27(13-20-5-3-4-6-21(20)16-33)30(38)34-23-10-7-19(8-11-23)31(39)40/h3-12,14-15,17,27H,13H2,1-2H3,(H,34,38)(H,39,40)
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n/an/a 73n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439392
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2cccc(c2)C#N)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H24ClN3O6/c1-18(36)24-11-8-22(32)14-25(24)26-15-29(37)35(17-28(26)41-2)27(13-19-4-3-5-20(12-19)16-33)30(38)34-23-9-6-21(7-10-23)31(39)40/h3-12,14-15,17,27H,13H2,1-2H3,(H,34,38)(H,39,40)
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n/an/a 74n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439435
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES CCCCC(C(=O)Nc1ccc(cc1)C(O)=O)n1cc(OC)c(cc1=O)-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C27H27ClN2O6/c1-4-5-6-23(26(33)29-19-10-7-17(8-11-19)27(34)35)30-15-24(36-3)22(14-25(30)32)21-13-18(28)9-12-20(21)16(2)31/h7-15,23H,4-6H2,1-3H3,(H,29,33)(H,34,35)
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n/an/a 81n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439360
PNG
(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxopyri...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc3[nH]cnc3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
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n/an/a 82n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439348
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccccc2)C(=O)Nc2ccc(cc2F)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H24ClFN2O6/c1-17(35)21-10-9-20(31)14-22(21)23-15-28(36)34(16-27(23)40-2)26(12-18-6-4-3-5-7-18)29(37)33-25-11-8-19(30(38)39)13-24(25)32/h3-11,13-16,26H,12H2,1-2H3,(H,33,37)(H,38,39)
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n/an/a 90n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439449
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(CC2CC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C27H25ClN2O6/c1-15(31)20-10-7-18(28)12-21(20)22-13-25(32)30(14-24(22)36-2)23(11-16-3-4-16)26(33)29-19-8-5-17(6-9-19)27(34)35/h5-10,12-14,16,23H,3-4,11H2,1-2H3,(H,29,33)(H,34,35)
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n/an/a 92n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439386
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](Cc2ccccn2)C(=O)Nc2ccc(cc2)C(N)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H25ClN4O5/c1-17(35)22-11-8-19(30)13-23(22)24-15-27(36)34(16-26(24)39-2)25(14-21-5-3-4-12-32-21)29(38)33-20-9-6-18(7-10-20)28(31)37/h3-13,15-16,25H,14H2,1-2H3,(H2,31,37)(H,33,38)/t25-/m0/s1
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n/an/a 92n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439389
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccncc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H24ClN3O6/c1-17(34)22-8-5-20(30)14-23(22)24-15-27(35)33(16-26(24)39-2)25(13-18-9-11-31-12-10-18)28(36)32-21-6-3-19(4-7-21)29(37)38/h3-12,14-16,25H,13H2,1-2H3,(H,32,36)(H,37,38)
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n/an/a 99n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439394
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccc(cc2)C#N)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H24ClN3O6/c1-18(36)24-12-9-22(32)14-25(24)26-15-29(37)35(17-28(26)41-2)27(13-19-3-5-20(16-33)6-4-19)30(38)34-23-10-7-21(8-11-23)31(39)40/h3-12,14-15,17,27H,13H2,1-2H3,(H,34,38)(H,39,40)
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n/an/a 100n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439428
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@@H](CCOC(C)(C)C)C(=O)Nc2ccc(cc2)C(N)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H32ClN3O6/c1-17(34)21-11-8-19(30)14-22(21)23-15-26(35)33(16-25(23)38-5)24(12-13-39-29(2,3)4)28(37)32-20-9-6-18(7-10-20)27(31)36/h6-11,14-16,24H,12-13H2,1-5H3,(H2,31,36)(H,32,37)/t24-/m0/s1
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n/an/a 100n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439376
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2c(Cl)cccc2Cl)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H23Cl3N2O6/c1-16(36)20-11-8-18(31)12-21(20)22-14-28(37)35(15-27(22)41-2)26(13-23-24(32)4-3-5-25(23)33)29(38)34-19-9-6-17(7-10-19)30(39)40/h3-12,14-15,26H,13H2,1-2H3,(H,34,38)(H,39,40)
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n/an/a 100n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439335
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccc(NC(=O)C3CC3)cc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C34H30ClN3O7/c1-19(39)26-14-9-23(35)16-27(26)28-17-31(40)38(18-30(28)45-2)29(33(42)37-25-12-7-22(8-13-25)34(43)44)15-20-3-10-24(11-4-20)36-32(41)21-5-6-21/h3-4,7-14,16-18,21,29H,5-6,15H2,1-2H3,(H,36,41)(H,37,42)(H,43,44)
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n/an/a 100n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439375
PNG
(4-(3-(4-acetamidophenyl)-2-(4-(2-acetyl-5-chloroph...)
Show SMILES COc1cn(C(Cc2ccc(NC(C)=O)cc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C32H28ClN3O7/c1-18(37)25-13-8-22(33)15-26(25)27-16-30(39)36(17-29(27)43-3)28(14-20-4-9-23(10-5-20)34-19(2)38)31(40)35-24-11-6-21(7-12-24)32(41)42/h4-13,15-17,28H,14H2,1-3H3,(H,34,38)(H,35,40)(H,41,42)
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n/an/a 100n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439429
PNG
((S)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES CNC(=O)c1ccc(NC(=O)[C@H](CCOC(C)(C)C)n2cc(OC)c(cc2=O)-c2cc(Cl)ccc2C(C)=O)cc1
Show InChI InChI=1S/C30H34ClN3O6/c1-18(35)22-12-9-20(31)15-23(22)24-16-27(36)34(17-26(24)39-6)25(13-14-40-30(2,3)4)29(38)33-21-10-7-19(8-11-21)28(37)32-5/h7-12,15-17,25H,13-14H2,1-6H3,(H,32,37)(H,33,38)/t25-/m0/s1
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n/an/a 100n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439430
PNG
(4-(tert-butoxy)-2-(4-(5-chloro-2-propionylphenyl)-...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)C(CCOC(C)(C)C)C(=O)Nc1ccc2nc(C)c(C)nc2c1
Show InChI InChI=1S/C33H37ClN4O5/c1-8-29(39)23-11-9-21(34)15-24(23)25-17-31(40)38(18-30(25)42-7)28(13-14-43-33(4,5)6)32(41)37-22-10-12-26-27(16-22)36-20(3)19(2)35-26/h9-12,15-18,28H,8,13-14H2,1-7H3,(H,37,41)
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n/an/a 100n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439453
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(CC2CC(C)(C)C2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H31ClN2O6/c1-17(34)22-10-7-20(31)12-23(22)24-13-27(35)33(16-26(24)39-4)25(11-18-14-30(2,3)15-18)28(36)32-21-8-5-19(6-9-21)29(37)38/h5-10,12-13,16,18,25H,11,14-15H2,1-4H3,(H,32,36)(H,37,38)
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n/an/a 100n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439374
PNG
(4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxop...)
Show SMILES COc1cn(C(Cc2ccc(C)cc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H27ClN2O6/c1-18-4-6-20(7-5-18)14-27(30(37)33-23-11-8-21(9-12-23)31(38)39)34-17-28(40-3)26(16-29(34)36)25-15-22(32)10-13-24(25)19(2)35/h4-13,15-17,27H,14H2,1-3H3,(H,33,37)(H,38,39)
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n/an/a 100n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439343
PNG
((R)-4-(2-(4-(5-chloro-2-propionylphenyl)-5-methoxy...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)[C@H](Cc1ccccc1)C(=O)Nc1ccc(cc1)C(N)=O
Show InChI InChI=1S/C31H28ClN3O5/c1-3-27(36)23-14-11-21(32)16-24(23)25-17-29(37)35(18-28(25)40-2)26(15-19-7-5-4-6-8-19)31(39)34-22-12-9-20(10-13-22)30(33)38/h4-14,16-18,26H,3,15H2,1-2H3,(H2,33,38)(H,34,39)/t26-/m1/s1
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n/an/a 1.52E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439323
PNG
((R)-5-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COCC[C@H](C(=O)Nc1ccc2[nH]c(cc2c1)C(O)=O)n1cc(OC)c(cc1=O)-c1cc(Cl)ccc1C(C)=O
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n/an/a 1.74E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439326
PNG
((R)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@H](Cc2ccccc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H25ClN2O6/c1-18(34)23-13-10-21(31)15-24(23)25-16-28(35)33(17-27(25)39-2)26(14-19-6-4-3-5-7-19)29(36)32-22-11-8-20(9-12-22)30(37)38/h3-13,15-17,26H,14H2,1-2H3,(H,32,36)(H,37,38)/t26-/m1/s1
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n/an/a 1.82E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439381
PNG
((R)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@H](Cc2ccccn2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H24ClN3O6/c1-17(34)22-11-8-19(30)13-23(22)24-15-27(35)33(16-26(24)39-2)25(14-21-5-3-4-12-31-21)28(36)32-20-9-6-18(7-10-20)29(37)38/h3-13,15-16,25H,14H2,1-2H3,(H,32,36)(H,37,38)/t25-/m1/s1
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n/an/a 2.68E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439326
PNG
((R)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@H](Cc2ccccc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H25ClN2O6/c1-18(34)23-13-10-21(31)15-24(23)25-16-28(35)33(17-27(25)39-2)26(14-19-6-4-3-5-7-19)29(36)32-22-11-8-20(9-12-22)30(37)38/h3-13,15-17,26H,14H2,1-2H3,(H,32,36)(H,37,38)/t26-/m1/s1
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n/an/a 4.83E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439416
PNG
((R)-4-(4-(tert-butoxy)-2-(4-(5-chloro-2-propionylp...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)[C@H](CCOC(C)(C)C)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C30H33ClN2O7/c1-6-25(34)21-12-9-19(31)15-22(21)23-16-27(35)33(17-26(23)39-5)24(13-14-40-30(2,3)4)28(36)32-20-10-7-18(8-11-20)29(37)38/h7-12,15-17,24H,6,13-14H2,1-5H3,(H,32,36)(H,37,38)/t24-/m1/s1
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n/an/a 5.46E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439337
PNG
((R)-2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-oxo...)
Show SMILES COc1cn([C@H](Cc2ccccc2)C(=O)Nc2ccc3nn(C)cc3c2)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C31H27ClN4O4/c1-19(37)24-11-9-22(32)15-25(24)26-16-30(38)36(18-29(26)40-3)28(13-20-7-5-4-6-8-20)31(39)33-23-10-12-27-21(14-23)17-35(2)34-27/h4-12,14-18,28H,13H2,1-3H3,(H,33,39)/t28-/m1/s1
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n/an/a 5.69E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439399
PNG
((R)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@H](Cc2ccn(n2)C2CC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C30H27ClN4O6/c1-17(36)23-10-5-19(31)13-24(23)25-15-28(37)34(16-27(25)41-2)26(14-21-11-12-35(33-21)22-8-9-22)29(38)32-20-6-3-18(4-7-20)30(39)40/h3-7,10-13,15-16,22,26H,8-9,14H2,1-2H3,(H,32,38)(H,39,40)/t26-/m1/s1
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n/an/a 7.51E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439416
PNG
((R)-4-(4-(tert-butoxy)-2-(4-(5-chloro-2-propionylp...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)[C@H](CCOC(C)(C)C)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C30H33ClN2O7/c1-6-25(34)21-12-9-19(31)15-22(21)23-16-27(35)33(17-26(23)39-5)24(13-14-40-30(2,3)4)28(36)32-20-10-7-18(8-11-20)29(37)38/h7-12,15-17,24H,6,13-14H2,1-5H3,(H,32,36)(H,37,38)/t24-/m1/s1
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n/an/a 7.96E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439413
PNG
((R)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@H](Cc2cnn(C)c2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H25ClN4O6/c1-16(34)21-9-6-19(29)11-22(21)23-12-26(35)33(15-25(23)39-3)24(10-17-13-30-32(2)14-17)27(36)31-20-7-4-18(5-8-20)28(37)38/h4-9,11-15,24H,10H2,1-3H3,(H,31,36)(H,37,38)/t24-/m1/s1
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n/an/a 8.15E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439409
PNG
((R)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@H](Cc2ccn(C)n2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H25ClN4O6/c1-16(34)21-9-6-18(29)12-22(21)23-14-26(35)33(15-25(23)39-3)24(13-20-10-11-32(2)31-20)27(36)30-19-7-4-17(5-8-19)28(37)38/h4-12,14-15,24H,13H2,1-3H3,(H,30,36)(H,37,38)/t24-/m1/s1
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n/an/a 8.21E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439452
PNG
((R)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@H](CC2CCC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H27ClN2O6/c1-16(32)21-11-8-19(29)13-22(21)23-14-26(33)31(15-25(23)37-2)24(12-17-4-3-5-17)27(34)30-20-9-6-18(7-10-20)28(35)36/h6-11,13-15,17,24H,3-5,12H2,1-2H3,(H,30,34)(H,35,36)/t24-/m1/s1
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n/an/a 8.92E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439445
PNG
((R)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@H](CCOC2CCC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H29ClN2O7/c1-17(33)22-11-8-19(30)14-23(22)24-15-27(34)32(16-26(24)38-2)25(12-13-39-21-4-3-5-21)28(35)31-20-9-6-18(7-10-20)29(36)37/h6-11,14-16,21,25H,3-5,12-13H2,1-2H3,(H,31,35)(H,36,37)/t25-/m1/s1
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n/an/a 9.11E+3n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439419
PNG
((R)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@H](CCOC(C)(C)C)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H31ClN2O7/c1-17(33)21-11-8-19(30)14-22(21)23-15-26(34)32(16-25(23)38-5)24(12-13-39-29(2,3)4)27(35)31-20-9-6-18(7-10-20)28(36)37/h6-11,14-16,24H,12-13H2,1-5H3,(H,31,35)(H,36,37)/t24-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439383
PNG
((R)-4-(2-(4-(2-acetyl-5-chlorophenyl)-5-methoxy-2-...)
Show SMILES COc1cn([C@H](Cc2cccnc2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1cc(Cl)ccc1C(C)=O
Show InChI InChI=1S/C29H24ClN3O6/c1-17(34)22-10-7-20(30)13-23(22)24-14-27(35)33(16-26(24)39-2)25(12-18-4-3-11-31-15-18)28(36)32-21-8-5-19(6-9-21)29(37)38/h3-11,13-16,25H,12H2,1-2H3,(H,32,36)(H,37,38)/t25-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439422
PNG
((R)-4-(tert-butoxy)-2-(4-(5-chloro-2-propionylphen...)
Show SMILES CCC(=O)c1ccc(Cl)cc1-c1cc(=O)n(cc1OC)[C@H](CCOC(C)(C)C)C(=O)Nc1ccc2nccnc2c1
Show InChI InChI=1S/C31H33ClN4O5/c1-6-27(37)21-9-7-19(32)15-22(21)23-17-29(38)36(18-28(23)40-5)26(11-14-41-31(2,3)4)30(39)35-20-8-10-24-25(16-20)34-13-12-33-24/h7-10,12-13,15-18,26H,6,11,14H2,1-5H3,(H,35,39)/t26-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM439443
PNG
((S)-4-(2-(4-(6-acetyl-3-chloro-2-fluorophenyl)-5-m...)
Show SMILES COc1cn([C@@H](CC2CCC2)C(=O)Nc2ccc(cc2)C(O)=O)c(=O)cc1-c1c(F)c(Cl)ccc1C(C)=O
Show InChI InChI=1S/C28H26ClFN2O6/c1-15(33)19-10-11-21(29)26(30)25(19)20-13-24(34)32(14-23(20)38-2)22(12-16-4-3-5-16)27(35)31-18-8-6-17(7-9-18)28(36)37/h6-11,13-14,16,22H,3-5,12H2,1-2H3,(H,31,35)(H,36,37)/t22-/m0/s1
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n/an/a 1.31E+4n/an/an/an/an/an/a



Jinagsu Hengrui Medicine Co., Ltd; Shanghai Hengrui Pharmaceutical Co., Ltd.

US Patent


Assay Description
Test Example 1: Biological Activity of the Compounds of the Present Invention onThe Inhibition of Factor XIa Detected by Absorption Photometry1. Expe...


US Patent US10633375 (2020)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%