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20 similar compounds to monomer 50142111

Compile data set for download or QSAR
Wt: 505.3
BDBM50142112
Wt: 561.4
BDBM50142113
Wt: 483.3
BDBM50142152
Wt: 555.4
BDBM50142171
Wt: 527.3
BDBM50142173
Wt: 545.4
BDBM50142092
Wt: 589.4
BDBM50142121
Wt: 498.4
BDBM50142183
Wt: 531.4
BDBM50142127
Wt: 561.4
BDBM50142129
Wt: 545.4
BDBM50142105
Wt: 531.4
BDBM50142133
Wt: 526.4
BDBM50142137
Wt: 499.3
BDBM50142140
Wt: 540.3
BDBM50193872
Displayed 1 to 15 (of 20 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 49 hits for monomerid = 50142112,50142113,50142152,50142171,50142173,50142092,50142121,50142183,50142127,50142129,50142105,50142133,50142137,50142140,50193872   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50142112
PNG
(2'-Dimethylamino-biphenyl-4-carboxylic acid [4-chl...)
Show SMILES CN(C)c1ccccc1-c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C27H22Cl2N4O2/c1-33(2)24-6-4-3-5-21(24)17-7-9-18(10-8-17)26(34)31-23-13-11-19(28)15-22(23)27(35)32-25-14-12-20(29)16-30-25/h3-16H,1-2H3,(H,31,34)(H,30,32,35)
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0.100n/an/an/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Coagulation factor X


Bioorg Med Chem Lett 14: 983-7 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.079
BindingDB Entry DOI: 10.7270/Q21V5DF7
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142129
PNG
(2'-(4-Hydroxy-piperidin-1-yl)-biphenyl-4-carboxyli...)
Show SMILES OC1CCN(CC1)c1ccccc1-c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C30H26Cl2N4O3/c31-21-9-11-26(25(17-21)30(39)35-28-12-10-22(32)18-33-28)34-29(38)20-7-5-19(6-8-20)24-3-1-2-4-27(24)36-15-13-23(37)14-16-36/h1-12,17-18,23,37H,13-16H2,(H,34,38)(H,33,35,39)
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0.200n/an/an/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Coagulation factor X


Bioorg Med Chem Lett 14: 983-7 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.079
BindingDB Entry DOI: 10.7270/Q21V5DF7
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50193872
PNG
(1-((4-(4-chloro-2-(5-chloropyridin-2-ylcarbamoyl)p...)
Show SMILES OC(=O)C1CCN(CC1)C(=N)c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C26H23Cl2N5O4/c27-18-5-7-21(20(13-18)25(35)32-22-8-6-19(28)14-30-22)31-24(34)16-3-1-15(2-4-16)23(29)33-11-9-17(10-12-33)26(36)37/h1-8,13-14,17,29H,9-12H2,(H,31,34)(H,36,37)(H,30,32,35)
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>1.00E+4n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human ERG by patch clamp assay


J Med Chem 53: 6243-74 (2010)


Article DOI: 10.1021/jm100146h
BindingDB Entry DOI: 10.7270/Q2CR5VBB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50193872
PNG
(1-((4-(4-chloro-2-(5-chloropyridin-2-ylcarbamoyl)p...)
Show SMILES OC(=O)C1CCN(CC1)C(=N)c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C26H23Cl2N5O4/c27-18-5-7-21(20(13-18)25(35)32-22-8-6-19(28)14-30-22)31-24(34)16-3-1-15(2-4-16)23(29)33-11-9-17(10-12-33)26(36)37/h1-8,13-14,17,29H,9-12H2,(H,31,34)(H,36,37)(H,30,32,35)
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>1.00E+4n/an/an/an/an/an/an/an/a



Portola Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG potassium channel expressed in HEK293 cells


Bioorg Med Chem Lett 16: 5507-12 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.039
BindingDB Entry DOI: 10.7270/Q2SF2X05
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142121
PNG
(1-{4'-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)...)
Show SMILES OC(=O)C1CCN(CC1)c1cccc(c1)-c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C31H26Cl2N4O4/c32-23-8-10-27(26(17-23)30(39)36-28-11-9-24(33)18-34-28)35-29(38)20-6-4-19(5-7-20)22-2-1-3-25(16-22)37-14-12-21(13-15-37)31(40)41/h1-11,16-18,21H,12-15H2,(H,35,38)(H,40,41)(H,34,36,39)
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n/an/a 1.80n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against coagulation factor Xa.


Bioorg Med Chem Lett 14: 983-7 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.079
BindingDB Entry DOI: 10.7270/Q21V5DF7
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142127
PNG
(2'-Pyrrolidin-1-yl-biphenyl-4-carboxylic acid [4-c...)
Show SMILES Clc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(cc2)-c2ccccc2N2CCCC2)nc1
Show InChI InChI=1S/C29H24Cl2N4O2/c30-21-11-13-25(24(17-21)29(37)34-27-14-12-22(31)18-32-27)33-28(36)20-9-7-19(8-10-20)23-5-1-2-6-26(23)35-15-3-4-16-35/h1-2,5-14,17-18H,3-4,15-16H2,(H,33,36)(H,32,34,37)
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n/an/a 2.80n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against coagulation factor Xa.


Bioorg Med Chem Lett 14: 983-7 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.079
BindingDB Entry DOI: 10.7270/Q21V5DF7
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142133
PNG
(3'-Pyrrolidin-1-yl-biphenyl-4-carboxylic acid [4-c...)
Show SMILES Clc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(cc2)-c2cccc(c2)N2CCCC2)nc1
Show InChI InChI=1S/C29H24Cl2N4O2/c30-22-10-12-26(25(17-22)29(37)34-27-13-11-23(31)18-32-27)33-28(36)20-8-6-19(7-9-20)21-4-3-5-24(16-21)35-14-1-2-15-35/h3-13,16-18H,1-2,14-15H2,(H,33,36)(H,32,34,37)
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n/an/a 5.30n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against coagulation factor Xa.


Bioorg Med Chem Lett 14: 983-7 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.079
BindingDB Entry DOI: 10.7270/Q21V5DF7
More data for this
Ligand-Target Pair
Trypsin-1


(Homo sapiens (Human))
BDBM50142137
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES NC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H25Cl2N5O3/c27-19-5-7-22(21(13-19)26(36)32-23-8-6-20(28)14-30-23)31-25(35)18-3-1-16(2-4-18)15-33-11-9-17(10-12-33)24(29)34/h1-8,13-14,17H,9-12,15H2,(H2,29,34)(H,31,35)(H,30,32,36)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against trypsin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142140
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(4-hydroxy...)
Show SMILES OC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H24Cl2N4O3/c26-18-5-7-22(21(13-18)25(34)30-23-8-6-19(27)14-28-23)29-24(33)17-3-1-16(2-4-17)15-31-11-9-20(32)10-12-31/h1-8,13-14,20,32H,9-12,15H2,(H,29,33)(H,28,30,34)
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n/an/a 136n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against coagulation factor X.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50142152
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-(4-piperidin-...)
Show SMILES Clc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(CN3CCCCC3)cc2)nc1
Show InChI InChI=1S/C25H24Cl2N4O2/c26-19-8-10-22(21(14-19)25(33)30-23-11-9-20(27)15-28-23)29-24(32)18-6-4-17(5-7-18)16-31-12-2-1-3-13-31/h4-11,14-15H,1-3,12-13,16H2,(H,29,32)(H,28,30,33)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against plasmin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM50142140
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(4-hydroxy...)
Show SMILES OC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H24Cl2N4O3/c26-18-5-7-22(21(13-18)25(34)30-23-8-6-19(27)14-28-23)29-24(33)17-3-1-16(2-4-17)15-31-11-9-20(32)10-12-31/h1-8,13-14,20,32H,9-12,15H2,(H,29,33)(H,28,30,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against tissue type plasminogen activator.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM50142152
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-(4-piperidin-...)
Show SMILES Clc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(CN3CCCCC3)cc2)nc1
Show InChI InChI=1S/C25H24Cl2N4O2/c26-19-8-10-22(21(14-19)25(33)30-23-11-9-20(27)15-28-23)29-24(32)18-6-4-17(5-7-18)16-31-12-2-1-3-13-31/h4-11,14-15H,1-3,12-13,16H2,(H,29,32)(H,28,30,33)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against tissue type plasminogen activator.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50142140
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(4-hydroxy...)
Show SMILES OC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H24Cl2N4O3/c26-18-5-7-22(21(13-18)25(34)30-23-8-6-19(27)14-28-23)29-24(33)17-3-1-16(2-4-17)15-31-11-9-20(32)10-12-31/h1-8,13-14,20,32H,9-12,15H2,(H,29,33)(H,28,30,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against thrombin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM50142137
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES NC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H25Cl2N5O3/c27-19-5-7-22(21(13-19)26(36)32-23-8-6-20(28)14-30-23)31-25(35)18-3-1-16(2-4-18)15-33-11-9-17(10-12-33)24(29)34/h1-8,13-14,17H,9-12,15H2,(H2,29,34)(H,31,35)(H,30,32,36)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against tissue type plasminogen activator.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142171
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES CCOC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C28H28Cl2N4O4/c1-2-38-28(37)20-11-13-34(14-12-20)17-18-3-5-19(6-4-18)26(35)32-24-9-7-21(29)15-23(24)27(36)33-25-10-8-22(30)16-31-25/h3-10,15-16,20H,2,11-14,17H2,1H3,(H,32,35)(H,31,33,36)
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n/an/a 171n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against coagulation factor X.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Trypsin-1


(Homo sapiens (Human))
BDBM50142173
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES OC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H24Cl2N4O4/c27-19-5-7-22(21(13-19)25(34)31-23-8-6-20(28)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-18(10-12-32)26(35)36/h1-8,13-14,18H,9-12,15H2,(H,30,33)(H,35,36)(H,29,31,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against trypsin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50142140
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(4-hydroxy...)
Show SMILES OC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H24Cl2N4O3/c26-18-5-7-22(21(13-18)25(34)30-23-8-6-19(27)14-28-23)29-24(33)17-3-1-16(2-4-17)15-31-11-9-20(32)10-12-31/h1-8,13-14,20,32H,9-12,15H2,(H,29,33)(H,28,30,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against plasmin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142137
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES NC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H25Cl2N5O3/c27-19-5-7-22(21(13-19)26(36)32-23-8-6-20(28)14-30-23)31-25(35)18-3-1-16(2-4-18)15-33-11-9-17(10-12-33)24(29)34/h1-8,13-14,17H,9-12,15H2,(H2,29,34)(H,31,35)(H,30,32,36)
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n/an/a 76n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against coagulation factor X.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50142137
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES NC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H25Cl2N5O3/c27-19-5-7-22(21(13-19)26(36)32-23-8-6-20(28)14-30-23)31-25(35)18-3-1-16(2-4-18)15-33-11-9-17(10-12-33)24(29)34/h1-8,13-14,17H,9-12,15H2,(H2,29,34)(H,31,35)(H,30,32,36)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against thrombin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Vitamin K-dependent protein C


(Homo sapiens (Human))
BDBM50142173
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES OC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H24Cl2N4O4/c27-19-5-7-22(21(13-19)25(34)31-23-8-6-20(28)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-18(10-12-32)26(35)36/h1-8,13-14,18H,9-12,15H2,(H,30,33)(H,35,36)(H,29,31,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against activated protein C


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM50142173
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES OC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H24Cl2N4O4/c27-19-5-7-22(21(13-19)25(34)31-23-8-6-20(28)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-18(10-12-32)26(35)36/h1-8,13-14,18H,9-12,15H2,(H,30,33)(H,35,36)(H,29,31,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against tissue type plasminogen activator.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50142173
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES OC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H24Cl2N4O4/c27-19-5-7-22(21(13-19)25(34)31-23-8-6-20(28)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-18(10-12-32)26(35)36/h1-8,13-14,18H,9-12,15H2,(H,30,33)(H,35,36)(H,29,31,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against thrombin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50142173
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES OC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H24Cl2N4O4/c27-19-5-7-22(21(13-19)25(34)31-23-8-6-20(28)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-18(10-12-32)26(35)36/h1-8,13-14,18H,9-12,15H2,(H,30,33)(H,35,36)(H,29,31,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against plasmin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50142152
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-(4-piperidin-...)
Show SMILES Clc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(CN3CCCCC3)cc2)nc1
Show InChI InChI=1S/C25H24Cl2N4O2/c26-19-8-10-22(21(14-19)25(33)30-23-11-9-20(27)15-28-23)29-24(32)18-6-4-17(5-7-18)16-31-12-2-1-3-13-31/h4-11,14-15H,1-3,12-13,16H2,(H,29,32)(H,28,30,33)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against thrombin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Trypsin-1


(Homo sapiens (Human))
BDBM50142152
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-(4-piperidin-...)
Show SMILES Clc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(CN3CCCCC3)cc2)nc1
Show InChI InChI=1S/C25H24Cl2N4O2/c26-19-8-10-22(21(14-19)25(33)30-23-11-9-20(27)15-28-23)29-24(32)18-6-4-17(5-7-18)16-31-12-2-1-3-13-31/h4-11,14-15H,1-3,12-13,16H2,(H,29,32)(H,28,30,33)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against trypsin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Trypsin-1


(Homo sapiens (Human))
BDBM50142183
PNG
(2-[4-(4-Amino-piperidin-1-ylmethyl)-benzoylamino]-...)
Show SMILES NC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H25Cl2N5O2/c26-18-5-7-22(21(13-18)25(34)31-23-8-6-19(27)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-20(28)10-12-32/h1-8,13-14,20H,9-12,15,28H2,(H,30,33)(H,29,31,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against trypsin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142173
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES OC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H24Cl2N4O4/c27-19-5-7-22(21(13-19)25(34)31-23-8-6-20(28)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-18(10-12-32)26(35)36/h1-8,13-14,18H,9-12,15H2,(H,30,33)(H,35,36)(H,29,31,34)
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n/an/a 230n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against coagulation factor X.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142183
PNG
(2-[4-(4-Amino-piperidin-1-ylmethyl)-benzoylamino]-...)
Show SMILES NC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H25Cl2N5O2/c26-18-5-7-22(21(13-18)25(34)31-23-8-6-19(27)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-20(28)10-12-32/h1-8,13-14,20H,9-12,15,28H2,(H,30,33)(H,29,31,34)
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Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against coagulation factor X.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Vitamin K-dependent protein C


(Homo sapiens (Human))
BDBM50142183
PNG
(2-[4-(4-Amino-piperidin-1-ylmethyl)-benzoylamino]-...)
Show SMILES NC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H25Cl2N5O2/c26-18-5-7-22(21(13-18)25(34)31-23-8-6-19(27)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-20(28)10-12-32/h1-8,13-14,20H,9-12,15,28H2,(H,30,33)(H,29,31,34)
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Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against activated protein C


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM50142183
PNG
(2-[4-(4-Amino-piperidin-1-ylmethyl)-benzoylamino]-...)
Show SMILES NC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H25Cl2N5O2/c26-18-5-7-22(21(13-18)25(34)31-23-8-6-19(27)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-20(28)10-12-32/h1-8,13-14,20H,9-12,15,28H2,(H,30,33)(H,29,31,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against tissue type plasminogen activator.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50142137
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES NC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H25Cl2N5O3/c27-19-5-7-22(21(13-19)26(36)32-23-8-6-20(28)14-30-23)31-25(35)18-3-1-16(2-4-18)15-33-11-9-17(10-12-33)24(29)34/h1-8,13-14,17H,9-12,15H2,(H2,29,34)(H,31,35)(H,30,32,36)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against plasmin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM50142171
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES CCOC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C28H28Cl2N4O4/c1-2-38-28(37)20-11-13-34(14-12-20)17-18-3-5-19(6-4-18)26(35)32-24-9-7-21(29)15-23(24)27(36)33-25-10-8-22(30)16-31-25/h3-10,15-16,20H,2,11-14,17H2,1H3,(H,32,35)(H,31,33,36)
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Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against tissue type plasminogen activator.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Trypsin-1


(Homo sapiens (Human))
BDBM50142140
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(4-hydroxy...)
Show SMILES OC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H24Cl2N4O3/c26-18-5-7-22(21(13-18)25(34)30-23-8-6-19(27)14-28-23)29-24(33)17-3-1-16(2-4-17)15-31-11-9-20(32)10-12-31/h1-8,13-14,20,32H,9-12,15H2,(H,29,33)(H,28,30,34)
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Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against trypsin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Vitamin K-dependent protein C


(Homo sapiens (Human))
BDBM50142140
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-[4-(4-hydroxy...)
Show SMILES OC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H24Cl2N4O3/c26-18-5-7-22(21(13-18)25(34)30-23-8-6-19(27)14-28-23)29-24(33)17-3-1-16(2-4-17)15-31-11-9-20(32)10-12-31/h1-8,13-14,20,32H,9-12,15H2,(H,29,33)(H,28,30,34)
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Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against activated protein C


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Trypsin-1


(Homo sapiens (Human))
BDBM50142171
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES CCOC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C28H28Cl2N4O4/c1-2-38-28(37)20-11-13-34(14-12-20)17-18-3-5-19(6-4-18)26(35)32-24-9-7-21(29)15-23(24)27(36)33-25-10-8-22(30)16-31-25/h3-10,15-16,20H,2,11-14,17H2,1H3,(H,32,35)(H,31,33,36)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against trypsin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142152
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-(4-piperidin-...)
Show SMILES Clc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(CN3CCCCC3)cc2)nc1
Show InChI InChI=1S/C25H24Cl2N4O2/c26-19-8-10-22(21(14-19)25(33)30-23-11-9-20(27)15-28-23)29-24(32)18-6-4-17(5-7-18)16-31-12-2-1-3-13-31/h4-11,14-15H,1-3,12-13,16H2,(H,29,32)(H,28,30,33)
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n/an/a 15n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against coagulation factor X.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50142183
PNG
(2-[4-(4-Amino-piperidin-1-ylmethyl)-benzoylamino]-...)
Show SMILES NC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H25Cl2N5O2/c26-18-5-7-22(21(13-18)25(34)31-23-8-6-19(27)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-20(28)10-12-32/h1-8,13-14,20H,9-12,15,28H2,(H,30,33)(H,29,31,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against plasmin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Vitamin K-dependent protein C


(Homo sapiens (Human))
BDBM50142171
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES CCOC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C28H28Cl2N4O4/c1-2-38-28(37)20-11-13-34(14-12-20)17-18-3-5-19(6-4-18)26(35)32-24-9-7-21(29)15-23(24)27(36)33-25-10-8-22(30)16-31-25/h3-10,15-16,20H,2,11-14,17H2,1H3,(H,32,35)(H,31,33,36)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against activated protein C


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50142183
PNG
(2-[4-(4-Amino-piperidin-1-ylmethyl)-benzoylamino]-...)
Show SMILES NC1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C25H25Cl2N5O2/c26-18-5-7-22(21(13-18)25(34)31-23-8-6-19(27)14-29-23)30-24(33)17-3-1-16(2-4-17)15-32-11-9-20(28)10-12-32/h1-8,13-14,20H,9-12,15,28H2,(H,30,33)(H,29,31,34)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against thrombin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Vitamin K-dependent protein C


(Homo sapiens (Human))
BDBM50142137
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES NC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C26H25Cl2N5O3/c27-19-5-7-22(21(13-19)26(36)32-23-8-6-20(28)14-30-23)31-25(35)18-3-1-16(2-4-18)15-33-11-9-17(10-12-33)24(29)34/h1-8,13-14,17H,9-12,15H2,(H2,29,34)(H,31,35)(H,30,32,36)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against activated protein C


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Vitamin K-dependent protein C


(Homo sapiens (Human))
BDBM50142152
PNG
(5-Chloro-N-(5-chloro-pyridin-2-yl)-2-(4-piperidin-...)
Show SMILES Clc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(CN3CCCCC3)cc2)nc1
Show InChI InChI=1S/C25H24Cl2N4O2/c26-19-8-10-22(21(14-19)25(33)30-23-11-9-20(27)15-28-23)29-24(32)18-6-4-17(5-7-18)16-31-12-2-1-3-13-31/h4-11,14-15H,1-3,12-13,16H2,(H,29,32)(H,28,30,33)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against activated protein C


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50142171
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES CCOC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C28H28Cl2N4O4/c1-2-38-28(37)20-11-13-34(14-12-20)17-18-3-5-19(6-4-18)26(35)32-24-9-7-21(29)15-23(24)27(36)33-25-10-8-22(30)16-31-25/h3-10,15-16,20H,2,11-14,17H2,1H3,(H,32,35)(H,31,33,36)
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Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against thrombin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50142171
PNG
(1-{4-[4-Chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-...)
Show SMILES CCOC(=O)C1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1
Show InChI InChI=1S/C28H28Cl2N4O4/c1-2-38-28(37)20-11-13-34(14-12-20)17-18-3-5-19(6-4-18)26(35)32-24-9-7-21(29)15-23(24)27(36)33-25-10-8-22(30)16-31-25/h3-10,15-16,20H,2,11-14,17H2,1H3,(H,32,35)(H,31,33,36)
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n/an/a>1.10E+4n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against plasmin.


Bioorg Med Chem Lett 14: 989-93 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.080
BindingDB Entry DOI: 10.7270/Q2X34WXD
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50193872
PNG
(1-((4-(4-chloro-2-(5-chloropyridin-2-ylcarbamoyl)p...)
Show SMILES OC(=O)C1CCN(CC1)C(=N)c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C26H23Cl2N5O4/c27-18-5-7-21(20(13-18)25(35)32-22-8-6-19(28)14-30-22)31-24(34)16-3-1-15(2-4-16)23(29)33-11-9-17(10-12-33)26(36)37/h1-8,13-14,17,29H,9-12H2,(H,31,34)(H,36,37)(H,30,32,35)
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n/an/a 2n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc

Curated by ChEMBL


Assay Description
Inhibition of Factor 10a (unknown origin)


Bioorg Med Chem Lett 19: 2179-85 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.111
BindingDB Entry DOI: 10.7270/Q22Z15F5
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142113
PNG
(3'-(4-Hydroxy-piperidin-1-yl)-biphenyl-4-carboxyli...)
Show SMILES OC1CCN(CC1)c1cccc(c1)-c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C30H26Cl2N4O3/c31-22-8-10-27(26(17-22)30(39)35-28-11-9-23(32)18-33-28)34-29(38)20-6-4-19(5-7-20)21-2-1-3-24(16-21)36-14-12-25(37)13-15-36/h1-11,16-18,25,37H,12-15H2,(H,34,38)(H,33,35,39)
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n/an/a 7n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against coagulation factor Xa.


Bioorg Med Chem Lett 14: 983-7 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.079
BindingDB Entry DOI: 10.7270/Q21V5DF7
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142105
PNG
(3'-Piperidin-1-yl-biphenyl-4-carboxylic acid [4-ch...)
Show SMILES Clc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(cc2)-c2cccc(c2)N2CCCCC2)nc1
Show InChI InChI=1S/C30H26Cl2N4O2/c31-23-11-13-27(26(18-23)30(38)35-28-14-12-24(32)19-33-28)34-29(37)21-9-7-20(8-10-21)22-5-4-6-25(17-22)36-15-2-1-3-16-36/h4-14,17-19H,1-3,15-16H2,(H,34,37)(H,33,35,38)
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n/an/a 16n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against coagulation factor Xa.


Bioorg Med Chem Lett 14: 983-7 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.079
BindingDB Entry DOI: 10.7270/Q21V5DF7
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142112
PNG
(2'-Dimethylamino-biphenyl-4-carboxylic acid [4-chl...)
Show SMILES CN(C)c1ccccc1-c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C27H22Cl2N4O2/c1-33(2)24-6-4-3-5-21(24)17-7-9-18(10-8-17)26(34)31-23-13-11-19(28)15-22(23)27(35)32-25-14-12-20(29)16-30-25/h3-16H,1-2H3,(H,31,34)(H,30,32,35)
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n/an/a 0.900n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Coagulation factor X


Bioorg Med Chem Lett 14: 983-7 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.079
BindingDB Entry DOI: 10.7270/Q21V5DF7
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142129
PNG
(2'-(4-Hydroxy-piperidin-1-yl)-biphenyl-4-carboxyli...)
Show SMILES OC1CCN(CC1)c1ccccc1-c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C30H26Cl2N4O3/c31-21-9-11-26(25(17-21)30(39)35-28-12-10-22(32)18-33-28)34-29(38)20-7-5-19(6-8-20)24-3-1-2-4-27(24)36-15-13-23(37)14-16-36/h1-12,17-18,23,37H,13-16H2,(H,34,38)(H,33,35,39)
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n/an/a 1n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against coagulation factor Xa.


Bioorg Med Chem Lett 14: 983-7 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.079
BindingDB Entry DOI: 10.7270/Q21V5DF7
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50142092
PNG
(2'-Piperidin-1-yl-biphenyl-4-carboxylic acid [4-ch...)
Show SMILES Clc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccc(cc2)-c2ccccc2N2CCCCC2)nc1
Show InChI InChI=1S/C30H26Cl2N4O2/c31-22-12-14-26(25(18-22)30(38)35-28-15-13-23(32)19-33-28)34-29(37)21-10-8-20(9-11-21)24-6-2-3-7-27(24)36-16-4-1-5-17-36/h2-3,6-15,18-19H,1,4-5,16-17H2,(H,34,37)(H,33,35,38)
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n/an/a 2.80n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against coagulation factor Xa.


Bioorg Med Chem Lett 14: 983-7 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.079
BindingDB Entry DOI: 10.7270/Q21V5DF7
More data for this
Ligand-Target Pair