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Compile Data Set for Download or QSAR

Found 72 hits Enz. Inhib. hit(s) with all data for entry = 50014537   
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 X


(Homo sapiens (Human))
BDBM50144092
PNG
(CHEMBL294121 | [4-(5-Chloro-1H-indole-2-sulfonyl)-...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1S/C23H24ClN5O3S/c1-27-9-8-25-22(27)16-2-4-17(5-3-16)23(30)28-10-12-29(13-11-28)33(31,32)21-15-18-14-19(24)6-7-20(18)26-21/h2-7,14-15,26H,8-13H2,1H3
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1.90n/an/an/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144106
PNG
(CHEMBL65146 | {4-(5-Chloro-1H-indole-2-sulfonyl)-1...)
Show SMILES COC(=O)CC1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C26H28ClN5O5S/c1-30-10-9-28-25(30)17-3-5-18(6-4-17)26(34)32-12-11-31(16-21(32)15-24(33)37-2)38(35,36)23-14-19-13-20(27)7-8-22(19)29-23/h3-8,13-14,21,29H,9-12,15-16H2,1-2H3
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n/an/a 3n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50144143
PNG
(2-{4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-[4-...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCOCC1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C29H32ClN5O5S2/c1-32-9-8-31-28(32)20-2-4-21(5-3-20)29(37)35-11-10-34(19-24(35)18-26(36)33-12-14-40-15-13-33)42(38,39)27-16-22-6-7-23(30)17-25(22)41-27/h2-7,16-17,24H,8-15,18-19H2,1H3
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n/an/a 3.20n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against thrombin was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144092
PNG
(CHEMBL294121 | [4-(5-Chloro-1H-indole-2-sulfonyl)-...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1S/C23H24ClN5O3S/c1-27-9-8-25-22(27)16-2-4-17(5-3-16)23(30)28-10-12-29(13-11-28)33(31,32)21-15-18-14-19(24)6-7-20(18)26-21/h2-7,14-15,26H,8-13H2,1H3
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n/an/a 5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144145
PNG
(1-Azetidin-1-yl-2-{4-(5-chloro-1H-indole-2-sulfony...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCC1)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C28H31ClN6O4S/c1-32-12-9-30-27(32)19-3-5-20(6-4-19)28(37)35-14-13-34(18-23(35)17-26(36)33-10-2-11-33)40(38,39)25-16-21-15-22(29)7-8-24(21)31-25/h3-8,15-16,23,31H,2,9-14,17-18H2,1H3
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n/an/a 5n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144096
PNG
(2-{4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-[4-...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCCCC1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C30H34ClN5O4S2/c1-33-14-11-32-29(33)21-5-7-22(8-6-21)30(38)36-16-15-35(20-25(36)19-27(37)34-12-3-2-4-13-34)42(39,40)28-17-23-9-10-24(31)18-26(23)41-28/h5-10,17-18,25H,2-4,11-16,19-20H2,1H3
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n/an/a 6n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144142
PNG
(2-{4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-[4-...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCCC1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C29H32ClN5O4S2/c1-32-13-10-31-28(32)20-4-6-21(7-5-20)29(37)35-15-14-34(19-24(35)18-26(36)33-11-2-3-12-33)41(38,39)27-16-22-8-9-23(30)17-25(22)40-27/h4-9,16-17,24H,2-3,10-15,18-19H2,1H3
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n/an/a 6n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144112
PNG
(2-{4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methy...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCCC1)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C29H33ClN6O4S/c1-33-13-10-31-28(33)20-4-6-21(7-5-20)29(38)36-15-14-35(19-24(36)18-27(37)34-11-2-3-12-34)41(39,40)26-17-22-16-23(30)8-9-25(22)32-26/h4-9,16-17,24,32H,2-3,10-15,18-19H2,1H3
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n/an/a 7n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144099
PNG
(2-{4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-[4-...)
Show SMILES CN(C)C(=O)CC1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C27H30ClN5O4S2/c1-30(2)24(34)16-22-17-32(39(36,37)25-14-20-8-9-21(28)15-23(20)38-25)12-13-33(22)27(35)19-6-4-18(5-7-19)26-29-10-11-31(26)3/h4-9,14-15,22H,10-13,16-17H2,1-3H3
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n/an/a 7n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144128
PNG
(2-{4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methy...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCCCC1)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C30H35ClN6O4S/c1-34-14-11-32-29(34)21-5-7-22(8-6-21)30(39)37-16-15-36(20-25(37)19-28(38)35-12-3-2-4-13-35)42(40,41)27-18-23-17-24(31)9-10-26(23)33-27/h5-10,17-18,25,33H,2-4,11-16,19-20H2,1H3
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n/an/a 7n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144136
PNG
(2-{4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methy...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCN(CC1)c1ccncc1)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C34H37ClN8O4S/c1-39-13-12-37-33(39)24-2-4-25(5-3-24)34(45)43-19-18-42(48(46,47)31-21-26-20-27(35)6-7-30(26)38-31)23-29(43)22-32(44)41-16-14-40(15-17-41)28-8-10-36-11-9-28/h2-11,20-21,29,38H,12-19,22-23H2,1H3
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n/an/a 8n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144126
PNG
(1-[4-(Azetidin-1-yl-imino-methyl)-benzyl]-4-(5-chl...)
Show SMILES Clc1ccc2[nH]c(cc2c1)S(=O)(=O)N1CCN(Cc2ccc(cc2)C(=N)N2CCC2)C(=O)C1
Show InChI InChI=1S/C23H24ClN5O3S/c24-19-6-7-20-18(12-19)13-21(26-20)33(31,32)29-11-10-28(22(30)15-29)14-16-2-4-17(5-3-16)23(25)27-8-1-9-27/h2-7,12-13,25-26H,1,8-11,14-15H2
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n/an/a 8n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144127
PNG
(2-{4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-[4-...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCN(CC1)c1ccncc1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C34H36ClN7O4S2/c1-38-13-12-37-33(38)24-2-4-25(5-3-24)34(44)42-19-18-41(48(45,46)32-20-26-6-7-27(35)21-30(26)47-32)23-29(42)22-31(43)40-16-14-39(15-17-40)28-8-10-36-11-9-28/h2-11,20-21,29H,12-19,22-23H2,1H3
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n/an/a 8n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144135
PNG
(1-(2-{4-(6-chloro-benzo[b]thiophene-2-sulfonyl)-1-...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCC(CC1)C(O)=O)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C31H34ClN5O6S2/c1-34-13-10-33-29(34)20-2-4-21(5-3-20)30(39)37-15-14-36(45(42,43)28-16-23-6-7-24(32)17-26(23)44-28)19-25(37)18-27(38)35-11-8-22(9-12-35)31(40)41/h2-7,16-17,22,25H,8-15,18-19H2,1H3,(H,40,41)
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n/an/a 8n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144114
PNG
(1-(2-{4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-...)
Show SMILES COC(=O)C1CCN(CC1)C(=O)CC1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C32H36ClN5O6S2/c1-35-14-11-34-30(35)21-3-5-22(6-4-21)31(40)38-16-15-37(46(42,43)29-17-24-7-8-25(33)18-27(24)45-29)20-26(38)19-28(39)36-12-9-23(10-13-36)32(41)44-2/h3-8,17-18,23,26H,9-16,19-20H2,1-2H3
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n/an/a 8n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144124
PNG
(CHEMBL293462 | [4-(6-Chloro-benzo[b]thiophene-2-su...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1S/C23H23ClN4O3S2/c1-26-9-8-25-22(26)16-2-4-17(5-3-16)23(29)27-10-12-28(13-11-27)33(30,31)21-14-18-6-7-19(24)15-20(18)32-21/h2-7,14-15H,8-13H2,1H3
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n/an/a 9n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50144124
PNG
(CHEMBL293462 | [4-(6-Chloro-benzo[b]thiophene-2-su...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1S/C23H23ClN4O3S2/c1-26-9-8-25-22(26)16-2-4-17(5-3-16)23(29)27-10-12-28(13-11-27)33(30,31)21-14-18-6-7-19(24)15-20(18)32-21/h2-7,14-15H,8-13H2,1H3
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n/an/a>10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity of the compound against thrombin was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144138
PNG
(1-Azetidin-1-yl-2-{4-(6-chloro-benzo[b]thiophene-2...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCC1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C28H30ClN5O4S2/c1-31-12-9-30-27(31)19-3-5-20(6-4-19)28(36)34-14-13-33(18-23(34)17-25(35)32-10-2-11-32)40(37,38)26-15-21-7-8-22(29)16-24(21)39-26/h3-8,15-16,23H,2,9-14,17-18H2,1H3
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n/an/a 10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144132
PNG
(2-{4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methy...)
Show SMILES CN(C)C(=O)CC1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C27H31ClN6O4S/c1-31(2)25(35)16-22-17-33(39(37,38)24-15-20-14-21(28)8-9-23(20)30-24)12-13-34(22)27(36)19-6-4-18(5-7-19)26-29-10-11-32(26)3/h4-9,14-15,22,30H,10-13,16-17H2,1-3H3
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n/an/a 10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144113
PNG
(1-[4-(Azetidin-1-yl-imino-methyl)-benzyl]-4-(6-chl...)
Show SMILES Clc1ccc2cc(sc2c1)S(=O)(=O)N1CCN(Cc2ccc(cc2)C(=N)N2CCC2)C(=O)C1
Show InChI InChI=1S/C23H23ClN4O3S2/c24-19-7-6-18-12-22(32-20(18)13-19)33(30,31)28-11-10-27(21(29)15-28)14-16-2-4-17(5-3-16)23(25)26-8-1-9-26/h2-7,12-13,25H,1,8-11,14-15H2
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n/an/a 11n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144111
PNG
(2-{4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methy...)
Show SMILES CNC(=O)CC1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C26H29ClN6O4S/c1-28-23(34)15-21-16-32(38(36,37)24-14-19-13-20(27)7-8-22(19)30-24)11-12-33(21)26(35)18-5-3-17(4-6-18)25-29-9-10-31(25)2/h3-8,13-14,21,30H,9-12,15-16H2,1-2H3,(H,28,34)
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n/an/a 11n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144084
PNG
(2-{4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methy...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCOCC1)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C29H33ClN6O5S/c1-33-9-8-31-28(33)20-2-4-21(5-3-20)29(38)36-11-10-35(19-24(36)18-27(37)34-12-14-41-15-13-34)42(39,40)26-17-22-16-23(30)6-7-25(22)32-26/h2-7,16-17,24,32H,8-15,18-19H2,1H3
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n/an/a 11n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144118
PNG
(4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methyl-4...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1C(O)=O)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C24H24ClN5O5S/c1-28-9-8-26-22(28)15-2-4-16(5-3-15)23(31)30-11-10-29(14-20(30)24(32)33)36(34,35)21-13-17-12-18(25)6-7-19(17)27-21/h2-7,12-13,20,27H,8-11,14H2,1H3,(H,32,33)
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n/an/a 12n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144133
PNG
(CHEMBL65816 | [4-(5-Chloro-1H-indole-2-sulfonyl)-p...)
Show SMILES CCN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1S/C24H26ClN5O3S/c1-2-28-10-9-26-23(28)17-3-5-18(6-4-17)24(31)29-11-13-30(14-12-29)34(32,33)22-16-19-15-20(25)7-8-21(19)27-22/h3-8,15-16,27H,2,9-14H2,1H3
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n/an/a 12n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144115
PNG
(CHEMBL63307 | {4-(6-Chloro-benzo[b]thiophene-2-sul...)
Show SMILES COC(=O)CC1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C26H27ClN4O5S2/c1-29-10-9-28-25(29)17-3-5-18(6-4-17)26(33)31-12-11-30(16-21(31)15-23(32)36-2)38(34,35)24-13-19-7-8-20(27)14-22(19)37-24/h3-8,13-14,21H,9-12,15-16H2,1-2H3
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n/an/a 13n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144097
PNG
(2-{4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methy...)
Show SMILES CN(CC#C)C(=O)CC1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C29H31ClN6O4S/c1-4-12-33(2)27(37)18-24-19-35(41(39,40)26-17-22-16-23(30)9-10-25(22)32-26)14-15-36(24)29(38)21-7-5-20(6-8-21)28-31-11-13-34(28)3/h1,5-10,16-17,24,32H,11-15,18-19H2,2-3H3
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n/an/a 14n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144143
PNG
(2-{4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-[4-...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(=O)N1CCOCC1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C29H32ClN5O5S2/c1-32-9-8-31-28(32)20-2-4-21(5-3-20)29(37)35-11-10-34(19-24(35)18-26(36)33-12-14-40-15-13-33)42(38,39)27-16-22-6-7-23(30)17-25(22)41-27/h2-7,16-17,24H,8-15,18-19H2,1H3
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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 was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144083
PNG
(2-{4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methy...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(N)=O)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C25H27ClN6O4S/c1-30-9-8-28-24(30)16-2-4-17(5-3-16)25(34)32-11-10-31(15-20(32)14-22(27)33)37(35,36)23-13-18-12-19(26)6-7-21(18)29-23/h2-7,12-13,20,29H,8-11,14-15H2,1H3,(H2,27,33)
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n/an/a 18n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144119
PNG
(2-{4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-[4-...)
Show SMILES CN(CC#C)C(=O)CC1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C29H30ClN5O4S2/c1-4-12-32(2)26(36)18-24-19-34(41(38,39)27-16-22-9-10-23(30)17-25(22)40-27)14-15-35(24)29(37)21-7-5-20(6-8-21)28-31-11-13-33(28)3/h1,5-10,16-17,24H,11-15,18-19H2,2-3H3
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n/an/a 19n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144104
PNG
(4-[4-(5-Chloro-1H-indole-2-sulfonyl)-piperazine-1-...)
Show SMILES CN(C)C(=N)c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1S/C22H24ClN5O3S/c1-26(2)21(24)15-3-5-16(6-4-15)22(29)27-9-11-28(12-10-27)32(30,31)20-14-17-13-18(23)7-8-19(17)25-20/h3-8,13-14,24-25H,9-12H2,1-2H3
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n/an/a 20n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144103
PNG
(CHEMBL417738 | [4-(Azetidin-1-yl-imino-methyl)-phe...)
Show SMILES Clc1ccc2[nH]c(cc2c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(cc1)C(=N)N1CCC1
Show InChI InChI=1S/C23H24ClN5O3S/c24-19-6-7-20-18(14-19)15-21(26-20)33(31,32)29-12-10-28(11-13-29)23(30)17-4-2-16(3-5-17)22(25)27-8-1-9-27/h2-7,14-15,25-26H,1,8-13H2
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n/an/a 24n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144130
PNG
(CHEMBL65128 | [4-(Azetidin-1-yl-imino-methyl)-phen...)
Show SMILES Clc1ccc2cc(sc2c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(cc1)C(=N)N1CCC1
Show InChI InChI=1S/C23H23ClN4O3S2/c24-19-7-6-18-14-21(32-20(18)15-19)33(30,31)28-12-10-27(11-13-28)23(29)17-4-2-16(3-5-17)22(25)26-8-1-9-26/h2-7,14-15,25H,1,8-13H2
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n/an/a 25n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144098
PNG
(4-[4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-piper...)
Show SMILES CN(C)C(=N)c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1S/C22H23ClN4O3S2/c1-25(2)21(24)15-3-5-16(6-4-15)22(28)26-9-11-27(12-10-26)32(29,30)20-13-17-7-8-18(23)14-19(17)31-20/h3-8,13-14,24H,9-12H2,1-2H3
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n/an/a 27n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144131
PNG
(4-[4-(5-Chloro-1H-indole-2-sulfonyl)-piperazine-1-...)
Show SMILES CCN(C)C(=N)c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1S/C23H26ClN5O3S/c1-3-27(2)22(25)16-4-6-17(7-5-16)23(30)28-10-12-29(13-11-28)33(31,32)21-15-18-14-19(24)8-9-20(18)26-21/h4-9,14-15,25-26H,3,10-13H2,1-2H3
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n/an/a 27n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144088
PNG
(4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methyl-4...)
Show SMILES COC(=O)C1CN(CCN1C(=O)c1ccc(cc1)C1=NCCN1C)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C25H26ClN5O5S/c1-29-10-9-27-23(29)16-3-5-17(6-4-16)24(32)31-12-11-30(15-21(31)25(33)36-2)37(34,35)22-14-18-13-19(26)7-8-20(18)28-22/h3-8,13-14,21,28H,9-12,15H2,1-2H3
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n/an/a 27n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144117
PNG
(CHEMBL291430 | {4-(6-Chloro-benzo[b]thiophene-2-su...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(O)=O)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1/C25H25ClN4O5S2/c1-28-9-8-27-24(28)16-2-4-17(5-3-16)25(33)30-11-10-29(15-20(30)14-22(31)32)37(34,35)23-12-18-6-7-19(26)13-21(18)36-23/h2-7,12-13,20H,8-11,14-15H2,1H3,(H,31,32)
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n/an/a 29n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144123
PNG
(4-[4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-2-oxo...)
Show SMILES CN(C)C(=N)c1ccc(CN2CCN(CC2=O)S(=O)(=O)c2cc3ccc(Cl)cc3s2)cc1
Show InChI InChI=1S/C22H23ClN4O3S2/c1-25(2)22(24)16-5-3-15(4-6-16)13-26-9-10-27(14-20(26)28)32(29,30)21-11-17-7-8-18(23)12-19(17)31-21/h3-8,11-12,24H,9-10,13-14H2,1-2H3
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n/an/a 30n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144109
PNG
(CHEMBL66535 | [4-(6-Bromo-naphthalene-2-sulfonyl)-...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1ccc2cc(Br)ccc2c1
Show InChI InChI=1S/C25H25BrN4O3S/c1-28-11-10-27-24(28)18-2-4-19(5-3-18)25(31)29-12-14-30(15-13-29)34(32,33)23-9-7-20-16-22(26)8-6-21(20)17-23/h2-9,16-17H,10-15H2,1H3
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n/an/a 31n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144085
PNG
(CHEMBL436356 | [4-(6-Chloro-benzo[b]thiophene-2-su...)
Show SMILES CCN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1S/C24H25ClN4O3S2/c1-2-27-10-9-26-23(27)17-3-5-18(6-4-17)24(30)28-11-13-29(14-12-28)34(31,32)22-15-19-7-8-20(25)16-21(19)33-22/h3-8,15-16H,2,9-14H2,1H3
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n/an/a 36n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144087
PNG
(4-[4-(5-Chloro-1H-indole-2-sulfonyl)-2-oxo-piperaz...)
Show SMILES CN(C)C(=N)c1ccc(CN2CCN(CC2=O)S(=O)(=O)c2cc3cc(Cl)ccc3[nH]2)cc1
Show InChI InChI=1S/C22H24ClN5O3S/c1-26(2)22(24)16-5-3-15(4-6-16)13-27-9-10-28(14-21(27)29)32(30,31)20-12-17-11-18(23)7-8-19(17)25-20/h3-8,11-12,24-25H,9-10,13-14H2,1-2H3
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n/an/a 37n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144116
PNG
(CHEMBL292941 | {4-(5-Chloro-1H-indole-2-sulfonyl)-...)
Show SMILES CN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1CC(O)=O)S(=O)(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1/C25H26ClN5O5S/c1-29-9-8-27-24(29)16-2-4-17(5-3-16)25(34)31-11-10-30(15-20(31)14-23(32)33)37(35,36)22-13-18-12-19(26)6-7-21(18)28-22/h2-7,12-13,20,28H,8-11,14-15H2,1H3,(H,32,33)
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n/an/a 41n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144108
PNG
(4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-[4-(1-...)
Show SMILES CN1CCN=C1c1ccc(CN2CCN(CC2=O)S(=O)(=O)c2cc3ccc(Cl)cc3s2)cc1
Show InChI InChI=1S/C23H23ClN4O3S2/c1-26-9-8-25-23(26)17-4-2-16(3-5-17)14-27-10-11-28(15-21(27)29)33(30,31)22-12-18-6-7-19(24)13-20(18)32-22/h2-7,12-13H,8-11,14-15H2,1H3
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n/an/a 45n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144140
PNG
(4-(5-Chloro-1H-indole-2-sulfonyl)-1-[4-(1-methyl-4...)
Show SMILES CN1CCN=C1c1ccc(CN2CCN(CC2=O)S(=O)(=O)c2cc3cc(Cl)ccc3[nH]2)cc1
Show InChI InChI=1S/C23H24ClN5O3S/c1-27-9-8-25-23(27)17-4-2-16(3-5-17)14-28-10-11-29(15-22(28)30)33(31,32)21-13-18-12-19(24)6-7-20(18)26-21/h2-7,12-13,26H,8-11,14-15H2,1H3
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n/an/a 57n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144101
PNG
(4-[4-(6-Bromo-naphthalene-2-sulfonyl)-piperazine-1...)
Show SMILES NC(=N)c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1ccc2cc(Br)ccc2c1
Show InChI InChI=1S/C22H21BrN4O3S/c23-19-7-5-18-14-20(8-6-17(18)13-19)31(29,30)27-11-9-26(10-12-27)22(28)16-3-1-15(2-4-16)21(24)25/h1-8,13-14H,9-12H2,(H3,24,25)
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n/an/a 64n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144100
PNG
(CHEMBL62758 | [4-(6-Bromo-naphthalene-2-sulfonyl)-...)
Show SMILES CCN1CCN=C1c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1ccc2cc(Br)ccc2c1
Show InChI InChI=1S/C26H27BrN4O3S/c1-2-29-12-11-28-25(29)19-3-5-20(6-4-19)26(32)30-13-15-31(16-14-30)35(33,34)24-10-8-21-17-23(27)9-7-22(21)18-24/h3-10,17-18H,2,11-16H2,1H3
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n/an/a 67n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144121
PNG
(CHEMBL66362 | [4-(6-Chloro-benzo[b]thiophene-2-sul...)
Show SMILES Clc1ccc2cc(sc2c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(cc1)C(=N)N1CCCC1
Show InChI InChI=1S/C24H25ClN4O3S2/c25-20-8-7-19-15-22(33-21(19)16-20)34(31,32)29-13-11-28(12-14-29)24(30)18-5-3-17(4-6-18)23(26)27-9-1-2-10-27/h3-8,15-16,26H,1-2,9-14H2
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n/an/a 70n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144122
PNG
(CHEMBL304859 | [4-(6-Chloro-benzo[b]thiophene-2-su...)
Show SMILES Clc1ccc2cc(sc2c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(cc1)C(=N)N1CCCCC1
Show InChI InChI=1S/C25H27ClN4O3S2/c26-21-9-8-20-16-23(34-22(20)17-21)35(32,33)30-14-12-29(13-15-30)25(31)19-6-4-18(5-7-19)24(27)28-10-2-1-3-11-28/h4-9,16-17,27H,1-3,10-15H2
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n/an/a 71n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144137
PNG
(CHEMBL292254 | [4-(5-Chloro-1H-indole-2-sulfonyl)-...)
Show SMILES Clc1ccc2[nH]c(cc2c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(cc1)C(=N)N1CCCC1
Show InChI InChI=1S/C24H26ClN5O3S/c25-20-7-8-21-19(15-20)16-22(27-21)34(32,33)30-13-11-29(12-14-30)24(31)18-5-3-17(4-6-18)23(26)28-9-1-2-10-28/h3-8,15-16,26-27H,1-2,9-14H2
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n/an/a 84n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144144
PNG
(4-[4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-piper...)
Show SMILES CCN(C)C(=N)c1ccc(cc1)C(=O)N1CCN(CC1)S(=O)(=O)c1cc2ccc(Cl)cc2s1
Show InChI InChI=1S/C23H25ClN4O3S2/c1-3-26(2)22(25)16-4-6-17(7-5-16)23(29)27-10-12-28(13-11-27)33(30,31)21-14-18-8-9-19(24)15-20(18)32-21/h4-9,14-15,25H,3,10-13H2,1-2H3
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n/an/a 90n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50144089
PNG
(4-(6-Chloro-benzo[b]thiophene-2-sulfonyl)-1-[4-(im...)
Show SMILES Clc1ccc2cc(sc2c1)S(=O)(=O)N1CCN(Cc2ccc(cc2)C(=N)N2CCCCC2)C(=O)C1
Show InChI InChI=1S/C25H27ClN4O3S2/c26-21-9-8-20-14-24(34-22(20)15-21)35(32,33)30-13-12-29(23(31)17-30)16-18-4-6-19(7-5-18)25(27)28-10-2-1-3-11-28/h4-9,14-15,27H,1-3,10-13,16-17H2
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n/an/a 100n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Coagulation factor X was determined


Bioorg Med Chem Lett 14: 2073-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.02.049
BindingDB Entry DOI: 10.7270/Q2P84B98
More data for this
Ligand-Target Pair
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