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PubMed code 10479288

Compile data set for download or QSAR
Found 141 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 X


(Homo sapiens (Human))
BDBM50080514
PNG
(3-[(R)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-7-5-16-6-8-20(13-18(16)12-19)32(29,30)26-21-9-10-27(23(21)28)14-15-3-2-4-17(11-15)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m1/s1
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0.0470n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM13279
PNG
(4-{[(3S)-3-[(7-methoxynaphthalene-2-)(methyl)sulfo...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(C)[C@H]1CCN(Cc2csc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C22H24N4O4S2/c1-25(19-7-8-26(22(19)27)12-14-9-20(21(23)24)31-13-14)32(28,29)18-6-4-15-3-5-17(30-2)10-16(15)11-18/h3-6,9-11,13,19H,7-8,12H2,1-2H3,(H3,23,24)/t19-/m0/s1
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7n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080482
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2csc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O4S2/c1-29-16-4-2-14-3-5-17(10-15(14)9-16)31(27,28)24-18-6-7-25(21(18)26)11-13-8-19(20(22)23)30-12-13/h2-5,8-10,12,18,24H,6-7,11H2,1H3,(H3,22,23)/t18-/m0/s1
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11n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080498
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-thiop...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccsc1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C28H28N4O4S2/c1-36-24-7-5-21-6-8-25(15-23(21)14-24)38(34,35)32(17-20-10-12-37-18-20)26-9-11-31(28(26)33)16-19-3-2-4-22(13-19)27(29)30/h2-8,10,12-15,18,26H,9,11,16-17H2,1H3,(H3,29,30)/t26-/m0/s1
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19n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080503
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-(1H-p...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccn[nH]1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C27H28N6O4S/c1-37-23-7-5-19-6-8-24(15-21(19)14-23)38(35,36)33(17-22-9-11-30-31-22)25-10-12-32(27(25)34)16-18-3-2-4-20(13-18)26(28)29/h2-9,11,13-15,25H,10,12,16-17H2,1H3,(H3,28,29)(H,30,31)/t25-/m0/s1
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21n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM13282
PNG
(3-{[(3S)-3-[(7-methoxynaphthalene-2-)(methyl)sulfo...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(C)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C24H26N4O4S/c1-27(33(30,31)21-9-7-17-6-8-20(32-2)13-19(17)14-21)22-10-11-28(24(22)29)15-16-4-3-5-18(12-16)23(25)26/h3-9,12-14,22H,10-11,15H2,1-2H3,(H3,25,26)/t22-/m0/s1
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22n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080475
PNG
(2-[[(S)-1-(3-Carbamimidoyl-benzyl)-2-oxo-pyrrolidi...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(CC(N)=O)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H27N5O5S/c1-35-20-7-5-17-6-8-21(13-19(17)12-20)36(33,34)30(15-23(26)31)22-9-10-29(25(22)32)14-16-3-2-4-18(11-16)24(27)28/h2-8,11-13,22H,9-10,14-15H2,1H3,(H2,26,31)(H3,27,28)/t22-/m0/s1
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25n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080500
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-pyrid...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccccn1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C29H29N5O4S/c1-38-25-10-8-21-9-11-26(17-23(21)16-25)39(36,37)34(19-24-7-2-3-13-32-24)27-12-14-33(29(27)35)18-20-5-4-6-22(15-20)28(30)31/h2-11,13,15-17,27H,12,14,18-19H2,1H3,(H3,30,31)/t27-/m0/s1
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31n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080496
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-thiop...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1cccs1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C28H28N4O4S2/c1-36-23-9-7-20-8-10-25(16-22(20)15-23)38(34,35)32(18-24-6-3-13-37-24)26-11-12-31(28(26)33)17-19-4-2-5-21(14-19)27(29)30/h2-10,13-16,26H,11-12,17-18H2,1H3,(H3,29,30)/t26-/m0/s1
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34n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080501
PNG
(3-{(S)-3-[Benzyl-(7-methoxy-naphthalene-2-sulfonyl...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccccc1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C30H30N4O4S/c1-38-26-12-10-23-11-13-27(18-25(23)17-26)39(36,37)34(20-21-6-3-2-4-7-21)28-14-15-33(30(28)35)19-22-8-5-9-24(16-22)29(31)32/h2-13,16-18,28H,14-15,19-20H2,1H3,(H3,31,32)/t28-/m0/s1
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41n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080510
PNG
(3-{(S)-3-[Ethyl-(7-methoxy-naphthalene-2-sulfonyl)...)
Show SMILES CCN([C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O)S(=O)(=O)c1ccc2ccc(OC)cc2c1
Show InChI InChI=1S/C25H28N4O4S/c1-3-29(34(31,32)22-10-8-18-7-9-21(33-2)14-20(18)15-22)23-11-12-28(25(23)30)16-17-5-4-6-19(13-17)24(26)27/h4-10,13-15,23H,3,11-12,16H2,1-2H3,(H3,26,27)/t23-/m0/s1
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43n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM13280
PNG
(3-{[(3S)-3-[(7-methoxynaphthalene-2-)sulfonamido]-...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-7-5-16-6-8-20(13-18(16)12-19)32(29,30)26-21-9-10-27(23(21)28)14-15-3-2-4-17(11-15)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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47n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080485
PNG
(3-[[(S)-1-(3-Carbamimidoyl-benzyl)-2-oxo-pyrrolidi...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(CCC(N)=O)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C26H29N5O5S/c1-36-21-7-5-18-6-8-22(15-20(18)14-21)37(34,35)31(12-10-24(27)32)23-9-11-30(26(23)33)16-17-3-2-4-19(13-17)25(28)29/h2-8,13-15,23H,9-12,16H2,1H3,(H2,27,32)(H3,28,29)/t23-/m0/s1
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56n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080487
PNG
(3-[(S)-3-(6-Chloro-naphthalene-2-sulfonylamino)-2-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C2=O)c1
Show InChI InChI=1S/C22H21ClN4O3S/c23-18-6-4-16-12-19(7-5-15(16)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-17(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13H2,(H3,24,25)/t20-/m0/s1
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70n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080476
PNG
(3-[(S)-3-(7-Chloro-naphthalene-2-sulfonylamino)-2-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(Cl)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H21ClN4O3S/c23-18-6-4-15-5-7-19(12-17(15)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-16(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13H2,(H3,24,25)/t20-/m0/s1
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78n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080479
PNG
(CHEMBL117156 | N-(3-Carbamimidoyl-benzyl)-2-(napht...)
Show SMILES NC(=N)c1cccc(CNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C20H20N4O3S/c21-20(22)17-7-3-4-14(10-17)12-23-19(25)13-24-28(26,27)18-9-8-15-5-1-2-6-16(15)11-18/h1-11,24H,12-13H2,(H3,21,22)(H,23,25)
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80n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080492
PNG
(5-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cc(cs2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O4S2/c1-29-16-4-2-13-3-5-18(10-14(13)8-16)31(27,28)24-19-6-7-25(21(19)26)11-17-9-15(12-30-17)20(22)23/h2-5,8-10,12,19,24H,6-7,11H2,1H3,(H3,22,23)/t19-/m0/s1
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83n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080506
PNG
(3-[(S)-3-(7-Methyl-naphthalene-2-sulfonylamino)-2-...)
Show SMILES Cc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C23H24N4O3S/c1-15-5-6-17-7-8-20(13-19(17)11-15)31(29,30)26-21-9-10-27(23(21)28)14-16-3-2-4-18(12-16)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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100n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080480
PNG
(3-[(S)-3-(3'-Methoxy-biphenyl-4-sulfonylamino)-2-o...)
Show SMILES COc1cccc(c1)-c1ccc(cc1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O4S/c1-33-21-7-3-5-19(15-21)18-8-10-22(11-9-18)34(31,32)28-23-12-13-29(25(23)30)16-17-4-2-6-20(14-17)24(26)27/h2-11,14-15,23,28H,12-13,16H2,1H3,(H3,26,27)/t23-/m0/s1
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100n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080481
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2ccnc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C22H23N5O4S/c1-31-17-4-2-15-3-5-18(12-16(15)11-17)32(29,30)26-19-7-9-27(22(19)28)13-14-6-8-25-20(10-14)21(23)24/h2-6,8,10-12,19,26H,7,9,13H2,1H3,(H3,23,24)/t19-/m0/s1
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110n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080504
PNG
(3-[(S)-3-(3'-Methyl-biphenyl-4-sulfonylamino)-2-ox...)
Show SMILES Cc1cccc(c1)-c1ccc(cc1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O3S/c1-17-4-2-6-20(14-17)19-8-10-22(11-9-19)33(31,32)28-23-12-13-29(25(23)30)16-18-5-3-7-21(15-18)24(26)27/h2-11,14-15,23,28H,12-13,16H2,1H3,(H3,26,27)/t23-/m0/s1
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120n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080505
PNG
(CHEMBL324337 | [[(S)-1-(3-Carbamimidoyl-benzyl)-2-...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(CC(O)=O)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O6S/c1-35-20-7-5-17-6-8-21(13-19(17)12-20)36(33,34)29(15-23(30)31)22-9-10-28(25(22)32)14-16-3-2-4-18(11-16)24(26)27/h2-8,11-13,22H,9-10,14-15H2,1H3,(H3,26,27)(H,30,31)/t22-/m0/s1
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120n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080499
PNG
(3-[(S)-3-(7-Amino-naphthalene-2-sulfonylamino)-2-o...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(N)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H23N5O3S/c23-18-6-4-15-5-7-19(12-17(15)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-16(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13,23H2,(H3,24,25)/t20-/m0/s1
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120n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM13290
PNG
(3-{[(3S)-2-oxo-3-[(4-phenylbenzene)sulfonamido]pyr...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)C2=O)c1 |r|
Show InChI InChI=1S/C24H24N4O3S/c25-23(26)20-8-4-5-17(15-20)16-28-14-13-22(24(28)29)27-32(30,31)21-11-9-19(10-12-21)18-6-2-1-3-7-18/h1-12,15,22,27H,13-14,16H2,(H3,25,26)/t22-/m0/s1
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160n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080507
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2coc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O5S/c1-29-16-4-2-14-3-5-17(10-15(14)9-16)31(27,28)24-18-6-7-25(21(18)26)11-13-8-19(20(22)23)30-12-13/h2-5,8-10,12,18,24H,6-7,11H2,1H3,(H3,22,23)/t18-/m0/s1
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180n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080489
PNG
(3-[(S)-3-(2'-Methoxy-biphenyl-4-sulfonylamino)-2-o...)
Show SMILES COc1ccccc1-c1ccc(cc1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O4S/c1-33-23-8-3-2-7-21(23)18-9-11-20(12-10-18)34(31,32)28-22-13-14-29(25(22)30)16-17-5-4-6-19(15-17)24(26)27/h2-12,15,22,28H,13-14,16H2,1H3,(H3,26,27)/t22-/m0/s1
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190n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080493
PNG
(5-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2ccc(s2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O4S2/c1-29-15-4-2-13-3-6-17(11-14(13)10-15)31(27,28)24-18-8-9-25(21(18)26)12-16-5-7-19(30-16)20(22)23/h2-7,10-11,18,24H,8-9,12H2,1H3,(H3,22,23)/t18-/m0/s1
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220n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080477
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C22H22N4O3S/c23-21(24)18-7-3-4-15(12-18)14-26-11-10-20(22(26)27)25-30(28,29)19-9-8-16-5-1-2-6-17(16)13-19/h1-9,12-13,20,25H,10-11,14H2,(H3,23,24)/t20-/m0/s1
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230n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080497
PNG
(3-[(S)-3-(7-Methylamino-naphthalene-2-sulfonylamin...)
Show SMILES CNc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C23H25N5O3S/c1-26-19-7-5-16-6-8-20(13-18(16)12-19)32(30,31)27-21-9-10-28(23(21)29)14-15-3-2-4-17(11-15)22(24)25/h2-8,11-13,21,26-27H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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250n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080483
PNG
(3-[(S)-3-(7-Ethoxy-naphthalene-2-sulfonylamino)-2-...)
Show SMILES CCOc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C24H26N4O4S/c1-2-32-20-8-6-17-7-9-21(14-19(17)13-20)33(30,31)27-22-10-11-28(24(22)29)15-16-4-3-5-18(12-16)23(25)26/h3-9,12-14,22,27H,2,10-11,15H2,1H3,(H3,25,26)/t22-/m0/s1
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280n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080479
PNG
(CHEMBL117156 | N-(3-Carbamimidoyl-benzyl)-2-(napht...)
Show SMILES NC(=N)c1cccc(CNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C20H20N4O3S/c21-20(22)17-7-3-4-14(10-17)12-23-19(25)13-24-28(26,27)18-9-8-15-5-1-2-6-16(15)11-18/h1-11,24H,12-13H2,(H3,21,22)(H,23,25)
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340n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080498
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-thiop...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccsc1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C28H28N4O4S2/c1-36-24-7-5-21-6-8-25(15-23(21)14-24)38(34,35)32(17-20-10-12-37-18-20)26-9-11-31(28(26)33)16-19-3-2-4-22(13-19)27(29)30/h2-8,10,12-15,18,26H,9,11,16-17H2,1H3,(H3,29,30)/t26-/m0/s1
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360n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080509
PNG
(3-[(S)-3-(7-Ethyl-naphthalene-2-sulfonylamino)-2-o...)
Show SMILES CCc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C24H26N4O3S/c1-2-16-6-7-18-8-9-21(14-20(18)12-16)32(30,31)27-22-10-11-28(24(22)29)15-17-4-3-5-19(13-17)23(25)26/h3-9,12-14,22,27H,2,10-11,15H2,1H3,(H3,25,26)/t22-/m0/s1
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370n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080508
PNG
(3-[(S)-2-Oxo-3-(4-phenoxy-benzenesulfonylamino)-py...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)C2=O)c1
Show InChI InChI=1S/C24H24N4O4S/c25-23(26)18-6-4-5-17(15-18)16-28-14-13-22(24(28)29)27-33(30,31)21-11-9-20(10-12-21)32-19-7-2-1-3-8-19/h1-12,15,22,27H,13-14,16H2,(H3,25,26)/t22-/m0/s1
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380n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080495
PNG
(3-[(S)-3-(Biphenyl-3-sulfonylamino)-2-oxo-pyrrolid...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3cccc(c3)-c3ccccc3)C2=O)c1
Show InChI InChI=1S/C24H24N4O3S/c25-23(26)20-10-4-6-17(14-20)16-28-13-12-22(24(28)29)27-32(30,31)21-11-5-9-19(15-21)18-7-2-1-3-8-18/h1-11,14-15,22,27H,12-13,16H2,(H3,25,26)/t22-/m0/s1
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440n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080511
PNG
(3-{(R)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-methy...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(C)[C@@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C24H26N4O4S/c1-27(33(30,31)21-9-7-17-6-8-20(32-2)13-19(17)14-21)22-10-11-28(24(22)29)15-16-4-3-5-18(12-16)23(25)26/h3-9,12-14,22H,10-11,15H2,1-2H3,(H3,25,26)/t22-/m1/s1
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440n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080501
PNG
(3-{(S)-3-[Benzyl-(7-methoxy-naphthalene-2-sulfonyl...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccccc1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C30H30N4O4S/c1-38-26-12-10-23-11-13-27(18-25(23)17-26)39(36,37)34(20-21-6-3-2-4-7-21)28-14-15-33(30(28)35)19-22-8-5-9-24(16-22)29(31)32/h2-13,16-18,28H,14-15,19-20H2,1H3,(H3,31,32)/t28-/m0/s1
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440n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080482
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2csc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O4S2/c1-29-16-4-2-14-3-5-17(10-15(14)9-16)31(27,28)24-18-6-7-25(21(18)26)11-13-8-19(20(22)23)30-12-13/h2-5,8-10,12,18,24H,6-7,11H2,1H3,(H3,22,23)/t18-/m0/s1
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500n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080494
PNG
(3-[(S)-3-(7-Hydroxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(O)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H22N4O4S/c23-21(24)16-3-1-2-14(10-16)13-26-9-8-20(22(26)28)25-31(29,30)19-7-5-15-4-6-18(27)11-17(15)12-19/h1-7,10-12,20,25,27H,8-9,13H2,(H3,23,24)/t20-/m0/s1
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500n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM13279
PNG
(4-{[(3S)-3-[(7-methoxynaphthalene-2-)(methyl)sulfo...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(C)[C@H]1CCN(Cc2csc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C22H24N4O4S2/c1-25(19-7-8-26(22(19)27)12-14-9-20(21(23)24)31-13-14)32(28,29)18-6-4-15-3-5-17(30-2)10-16(15)11-18/h3-6,9-11,13,19H,7-8,12H2,1-2H3,(H3,23,24)/t19-/m0/s1
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530n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080512
PNG
(5-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2ccc(o2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O5S/c1-29-15-4-2-13-3-6-17(11-14(13)10-15)31(27,28)24-18-8-9-25(21(18)26)12-16-5-7-19(30-16)20(22)23/h2-7,10-11,18,24H,8-9,12H2,1H3,(H3,22,23)/t18-/m0/s1
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570n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080479
PNG
(CHEMBL117156 | N-(3-Carbamimidoyl-benzyl)-2-(napht...)
Show SMILES NC(=N)c1cccc(CNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C20H20N4O3S/c21-20(22)17-7-3-4-14(10-17)12-23-19(25)13-24-28(26,27)18-9-8-15-5-1-2-6-16(15)11-18/h1-11,24H,12-13H2,(H3,21,22)(H,23,25)
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630n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM13282
PNG
(3-{[(3S)-3-[(7-methoxynaphthalene-2-)(methyl)sulfo...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(C)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C24H26N4O4S/c1-27(33(30,31)21-9-7-17-6-8-20(32-2)13-19(17)14-21)22-10-11-28(24(22)29)15-16-4-3-5-18(12-16)23(25)26/h3-9,12-14,22H,10-11,15H2,1-2H3,(H3,25,26)/t22-/m0/s1
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700n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080488
PNG
(3-[(S)-3-(Naphthalene-1-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3cccc4ccccc34)C2=O)c1
Show InChI InChI=1S/C22H22N4O3S/c23-21(24)17-8-3-5-15(13-17)14-26-12-11-19(22(26)27)25-30(28,29)20-10-4-7-16-6-1-2-9-18(16)20/h1-10,13,19,25H,11-12,14H2,(H3,23,24)/t19-/m0/s1
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750n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM13280
PNG
(3-{[(3S)-3-[(7-methoxynaphthalene-2-)sulfonamido]-...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-7-5-16-6-8-20(13-18(16)12-19)32(29,30)26-21-9-10-27(23(21)28)14-15-3-2-4-17(11-15)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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850n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080510
PNG
(3-{(S)-3-[Ethyl-(7-methoxy-naphthalene-2-sulfonyl)...)
Show SMILES CCN([C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O)S(=O)(=O)c1ccc2ccc(OC)cc2c1
Show InChI InChI=1S/C25H28N4O4S/c1-3-29(34(31,32)22-10-8-18-7-9-21(33-2)14-20(18)15-22)23-11-12-28(25(23)30)16-17-5-4-6-19(13-17)24(26)27/h4-10,13-15,23H,3,11-12,16H2,1-2H3,(H3,26,27)/t23-/m0/s1
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880n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080491
PNG
(3-[(S)-3-(6-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2cc(ccc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-7-5-17-13-20(8-6-16(17)12-19)32(29,30)26-21-9-10-27(23(21)28)14-15-3-2-4-18(11-15)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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900n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080478
PNG
(3-[3-(2-Naphthalen-2-yl-ethyl)-indol-1-ylmethyl]-b...)
Show SMILES NC(=N)c1cccc(Cn2cc(CCc3ccc4ccccc4c3)c3ccccc23)c1
Show InChI InChI=1S/C28H25N3/c29-28(30)24-9-5-6-21(17-24)18-31-19-25(26-10-3-4-11-27(26)31)15-13-20-12-14-22-7-1-2-8-23(22)16-20/h1-12,14,16-17,19H,13,15,18H2,(H3,29,30)
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900n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080492
PNG
(5-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cc(cs2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O4S2/c1-29-16-4-2-13-3-5-18(10-14(13)8-16)31(27,28)24-19-6-7-25(21(19)26)11-17-9-15(12-30-17)20(22)23/h2-5,8-10,12,19,24H,6-7,11H2,1H3,(H3,22,23)/t19-/m0/s1
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940n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080496
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-thiop...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1cccs1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C28H28N4O4S2/c1-36-23-9-7-20-8-10-25(16-22(20)15-23)38(34,35)32(18-24-6-3-13-37-24)26-11-12-31(28(26)33)17-19-4-2-5-21(14-19)27(29)30/h2-10,13-16,26H,11-12,17-18H2,1H3,(H3,29,30)/t26-/m0/s1
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970n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080486
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2ccc(cc2)C(N)=N)C1=O
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-8-6-16-7-9-20(13-18(16)12-19)32(29,30)26-21-10-11-27(23(21)28)14-15-2-4-17(5-3-15)22(24)25/h2-9,12-13,21,26H,10-11,14H2,1H3,(H3,24,25)/t21-/m0/s1
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970n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080491
PNG
(3-[(S)-3-(6-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2cc(ccc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-7-5-17-13-20(8-6-16(17)12-19)32(29,30)26-21-9-10-27(23(21)28)14-15-3-2-4-18(11-15)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080475
PNG
(2-[[(S)-1-(3-Carbamimidoyl-benzyl)-2-oxo-pyrrolidi...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(CC(N)=O)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H27N5O5S/c1-35-20-7-5-17-6-8-21(13-19(17)12-20)36(33,34)30(15-23(26)31)22-9-10-29(25(22)32)14-16-3-2-4-18(11-16)24(27)28/h2-8,11-13,22H,9-10,14-15H2,1H3,(H2,26,31)(H3,27,28)/t22-/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM13279
PNG
(4-{[(3S)-3-[(7-methoxynaphthalene-2-)(methyl)sulfo...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(C)[C@H]1CCN(Cc2csc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C22H24N4O4S2/c1-25(19-7-8-26(22(19)27)12-14-9-20(21(23)24)31-13-14)32(28,29)18-6-4-15-3-5-17(30-2)10-16(15)11-18/h3-6,9-11,13,19H,7-8,12H2,1-2H3,(H3,23,24)/t19-/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of thrombin.


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080498
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-thiop...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccsc1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C28H28N4O4S2/c1-36-24-7-5-21-6-8-25(15-23(21)14-24)38(34,35)32(17-20-10-12-37-18-20)26-9-11-31(28(26)33)16-19-3-2-4-22(13-19)27(29)30/h2-8,10,12-15,18,26H,9,11,16-17H2,1H3,(H3,29,30)/t26-/m0/s1
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1.08E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080503
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-(1H-p...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccn[nH]1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C27H28N6O4S/c1-37-23-7-5-19-6-8-24(15-21(19)14-23)38(35,36)33(17-22-9-11-30-31-22)25-10-12-32(27(25)34)16-18-3-2-4-20(13-18)26(28)29/h2-9,11,13-15,25H,10,12,16-17H2,1H3,(H3,28,29)(H,30,31)/t25-/m0/s1
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1.08E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080474
PNG
(3-[(S)-3-(4-Benzyl-benzenesulfonylamino)-2-oxo-pyr...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc(Cc4ccccc4)cc3)C2=O)c1
Show InChI InChI=1S/C25H26N4O3S/c26-24(27)21-8-4-7-20(16-21)17-29-14-13-23(25(29)30)28-33(31,32)22-11-9-19(10-12-22)15-18-5-2-1-3-6-18/h1-12,16,23,28H,13-15,17H2,(H3,26,27)/t23-/m0/s1
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1.10E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080506
PNG
(3-[(S)-3-(7-Methyl-naphthalene-2-sulfonylamino)-2-...)
Show SMILES Cc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C23H24N4O3S/c1-15-5-6-17-7-8-20(13-19(17)11-15)31(29,30)26-21-9-10-27(23(21)28)14-16-3-2-4-18(12-16)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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1.10E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM13282
PNG
(3-{[(3S)-3-[(7-methoxynaphthalene-2-)(methyl)sulfo...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(C)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C24H26N4O4S/c1-27(33(30,31)21-9-7-17-6-8-20(32-2)13-19(17)14-21)22-10-11-28(24(22)29)15-16-4-3-5-18(12-16)23(25)26/h3-9,12-14,22H,10-11,15H2,1-2H3,(H3,25,26)/t22-/m0/s1
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1.10E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080500
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-pyrid...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccccn1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C29H29N5O4S/c1-38-25-10-8-21-9-11-26(17-23(21)16-25)39(36,37)34(19-24-7-2-3-13-32-24)27-12-14-33(29(27)35)18-20-5-4-6-22(15-20)28(30)31/h2-11,13,15-17,27H,12,14,18-19H2,1H3,(H3,30,31)/t27-/m0/s1
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1.16E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080476
PNG
(3-[(S)-3-(7-Chloro-naphthalene-2-sulfonylamino)-2-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(Cl)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H21ClN4O3S/c23-18-6-4-15-5-7-19(12-17(15)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-16(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13H2,(H3,24,25)/t20-/m0/s1
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1.20E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Vitamin K-dependent protein C


(Homo sapiens (Human))
BDBM13280
PNG
(3-{[(3S)-3-[(7-methoxynaphthalene-2-)sulfonamido]-...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-7-5-16-6-8-20(13-18(16)12-19)32(29,30)26-21-9-10-27(23(21)28)14-15-3-2-4-17(11-15)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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1.20E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of activated protein C (aPC)


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080499
PNG
(3-[(S)-3-(7-Amino-naphthalene-2-sulfonylamino)-2-o...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(N)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H23N5O3S/c23-18-6-4-15-5-7-19(12-17(15)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-16(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13,23H2,(H3,24,25)/t20-/m0/s1
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1.30E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080473
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-piper...)
Show SMILES NC(=N)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C23H24N4O3S/c24-22(25)19-8-3-5-16(13-19)15-27-12-4-9-21(23(27)28)26-31(29,30)20-11-10-17-6-1-2-7-18(17)14-20/h1-3,5-8,10-11,13-14,21,26H,4,9,12,15H2,(H3,24,25)/t21-/m0/s1
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1.30E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080482
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2csc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O4S2/c1-29-16-4-2-14-3-5-17(10-15(14)9-16)31(27,28)24-18-6-7-25(21(18)26)11-13-8-19(20(22)23)30-12-13/h2-5,8-10,12,18,24H,6-7,11H2,1H3,(H3,22,23)/t18-/m0/s1
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1.30E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080506
PNG
(3-[(S)-3-(7-Methyl-naphthalene-2-sulfonylamino)-2-...)
Show SMILES Cc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C23H24N4O3S/c1-15-5-6-17-7-8-20(13-19(17)11-15)31(29,30)26-21-9-10-27(23(21)28)14-16-3-2-4-18(12-16)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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1.34E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080503
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-(1H-p...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccn[nH]1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C27H28N6O4S/c1-37-23-7-5-19-6-8-24(15-21(19)14-23)38(35,36)33(17-22-9-11-30-31-22)25-10-12-32(27(25)34)16-18-3-2-4-20(13-18)26(28)29/h2-9,11,13-15,25H,10,12,16-17H2,1H3,(H3,28,29)(H,30,31)/t25-/m0/s1
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1.39E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080510
PNG
(3-{(S)-3-[Ethyl-(7-methoxy-naphthalene-2-sulfonyl)...)
Show SMILES CCN([C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O)S(=O)(=O)c1ccc2ccc(OC)cc2c1
Show InChI InChI=1S/C25H28N4O4S/c1-3-29(34(31,32)22-10-8-18-7-9-21(33-2)14-20(18)15-22)23-11-12-28(25(23)30)16-17-5-4-6-19(13-17)24(26)27/h4-10,13-15,23H,3,11-12,16H2,1-2H3,(H3,26,27)/t23-/m0/s1
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1.40E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM13280
PNG
(3-{[(3S)-3-[(7-methoxynaphthalene-2-)sulfonamido]-...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-7-5-16-6-8-20(13-18(16)12-19)32(29,30)26-21-9-10-27(23(21)28)14-15-3-2-4-17(11-15)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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1.40E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080475
PNG
(2-[[(S)-1-(3-Carbamimidoyl-benzyl)-2-oxo-pyrrolidi...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(CC(N)=O)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H27N5O5S/c1-35-20-7-5-17-6-8-21(13-19(17)12-20)36(33,34)30(15-23(26)31)22-9-10-29(25(22)32)14-16-3-2-4-18(11-16)24(27)28/h2-8,11-13,22H,9-10,14-15H2,1H3,(H2,26,31)(H3,27,28)/t22-/m0/s1
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1.44E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080487
PNG
(3-[(S)-3-(6-Chloro-naphthalene-2-sulfonylamino)-2-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C2=O)c1
Show InChI InChI=1S/C22H21ClN4O3S/c23-18-6-4-16-12-19(7-5-15(16)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-17(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13H2,(H3,24,25)/t20-/m0/s1
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1.50E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080497
PNG
(3-[(S)-3-(7-Methylamino-naphthalene-2-sulfonylamin...)
Show SMILES CNc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C23H25N5O3S/c1-26-19-7-5-16-6-8-20(13-18(16)12-19)32(30,31)27-21-9-10-28(23(21)29)14-15-3-2-4-17(11-15)22(24)25/h2-8,11-13,21,26-27H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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1.50E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080485
PNG
(3-[[(S)-1-(3-Carbamimidoyl-benzyl)-2-oxo-pyrrolidi...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(CCC(N)=O)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C26H29N5O5S/c1-36-21-7-5-18-6-8-22(15-20(18)14-21)37(34,35)31(12-10-24(27)32)23-9-11-30(26(23)33)16-17-3-2-4-19(13-17)25(28)29/h2-8,13-15,23H,9-12,16H2,1H3,(H2,27,32)(H3,28,29)/t23-/m0/s1
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1.50E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080509
PNG
(3-[(S)-3-(7-Ethyl-naphthalene-2-sulfonylamino)-2-o...)
Show SMILES CCc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C24H26N4O3S/c1-2-16-6-7-18-8-9-21(14-20(18)12-16)32(30,31)27-22-10-11-28(24(22)29)15-17-4-3-5-19(13-17)23(25)26/h3-9,12-14,22,27H,2,10-11,15H2,1H3,(H3,25,26)/t22-/m0/s1
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1.60E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080509
PNG
(3-[(S)-3-(7-Ethyl-naphthalene-2-sulfonylamino)-2-o...)
Show SMILES CCc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C24H26N4O3S/c1-2-16-6-7-18-8-9-21(14-20(18)12-16)32(30,31)27-22-10-11-28(24(22)29)15-17-4-3-5-19(13-17)23(25)26/h3-9,12-14,22,27H,2,10-11,15H2,1H3,(H3,25,26)/t22-/m0/s1
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1.60E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080501
PNG
(3-{(S)-3-[Benzyl-(7-methoxy-naphthalene-2-sulfonyl...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccccc1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C30H30N4O4S/c1-38-26-12-10-23-11-13-27(18-25(23)17-26)39(36,37)34(20-21-6-3-2-4-7-21)28-14-15-33(30(28)35)19-22-8-5-9-24(16-22)29(31)32/h2-13,16-18,28H,14-15,19-20H2,1H3,(H3,31,32)/t28-/m0/s1
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1.80E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080483
PNG
(3-[(S)-3-(7-Ethoxy-naphthalene-2-sulfonylamino)-2-...)
Show SMILES CCOc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C24H26N4O4S/c1-2-32-20-8-6-17-7-9-21(14-19(17)13-20)33(30,31)27-22-10-11-28(24(22)29)15-16-4-3-5-18(12-16)23(25)26/h3-9,12-14,22,27H,2,10-11,15H2,1H3,(H3,25,26)/t22-/m0/s1
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1.90E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080500
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-pyrid...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1ccccn1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C29H29N5O4S/c1-38-25-10-8-21-9-11-26(17-23(21)16-25)39(36,37)34(19-24-7-2-3-13-32-24)27-12-14-33(29(27)35)18-20-5-4-6-22(15-20)28(30)31/h2-11,13,15-17,27H,12,14,18-19H2,1H3,(H3,30,31)/t27-/m0/s1
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1.94E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080496
PNG
(3-{(S)-3-[(7-Methoxy-naphthalene-2-sulfonyl)-thiop...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(Cc1cccs1)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C28H28N4O4S2/c1-36-23-9-7-20-8-10-25(16-22(20)15-23)38(34,35)32(18-24-6-3-13-37-24)26-11-12-31(28(26)33)17-19-4-2-5-21(14-19)27(29)30/h2-10,13-16,26H,11-12,17-18H2,1H3,(H3,29,30)/t26-/m0/s1
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1.94E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080485
PNG
(3-[[(S)-1-(3-Carbamimidoyl-benzyl)-2-oxo-pyrrolidi...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(CCC(N)=O)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C26H29N5O5S/c1-36-21-7-5-18-6-8-22(15-20(18)14-21)37(34,35)31(12-10-24(27)32)23-9-11-30(26(23)33)16-17-3-2-4-19(13-17)25(28)29/h2-8,13-15,23H,9-12,16H2,1H3,(H2,27,32)(H3,28,29)/t23-/m0/s1
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2.00E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080476
PNG
(3-[(S)-3-(7-Chloro-naphthalene-2-sulfonylamino)-2-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(Cl)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H21ClN4O3S/c23-18-6-4-15-5-7-19(12-17(15)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-16(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13H2,(H3,24,25)/t20-/m0/s1
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2.00E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080481
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2ccnc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C22H23N5O4S/c1-31-17-4-2-15-3-5-18(12-16(15)11-17)32(29,30)26-19-7-9-27(22(19)28)13-14-6-8-25-20(10-14)21(23)24/h2-6,8,10-12,19,26H,7,9,13H2,1H3,(H3,23,24)/t19-/m0/s1
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2.04E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080486
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2ccc(cc2)C(N)=N)C1=O
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-8-6-16-7-9-20(13-18(16)12-19)32(29,30)26-21-10-11-27(23(21)28)14-15-2-4-17(5-3-15)22(24)25/h2-9,12-13,21,26H,10-11,14H2,1H3,(H3,24,25)/t21-/m0/s1
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2.30E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Vitamin K-dependent protein C


(Homo sapiens (Human))
BDBM13279
PNG
(4-{[(3S)-3-[(7-methoxynaphthalene-2-)(methyl)sulfo...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(C)[C@H]1CCN(Cc2csc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C22H24N4O4S2/c1-25(19-7-8-26(22(19)27)12-14-9-20(21(23)24)31-13-14)32(28,29)18-6-4-15-3-5-17(30-2)10-16(15)11-18/h3-6,9-11,13,19H,7-8,12H2,1-2H3,(H3,23,24)/t19-/m0/s1
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2.40E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of activated protein C (aPC)


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080492
PNG
(5-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cc(cs2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O4S2/c1-29-16-4-2-13-3-5-18(10-14(13)8-16)31(27,28)24-19-6-7-25(21(19)26)11-17-9-15(12-30-17)20(22)23/h2-5,8-10,12,19,24H,6-7,11H2,1H3,(H3,22,23)/t19-/m0/s1
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2.40E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080480
PNG
(3-[(S)-3-(3'-Methoxy-biphenyl-4-sulfonylamino)-2-o...)
Show SMILES COc1cccc(c1)-c1ccc(cc1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O4S/c1-33-21-7-3-5-19(15-21)18-8-10-22(11-9-18)34(31,32)28-23-12-13-29(25(23)30)16-17-4-2-6-20(14-17)24(26)27/h2-11,14-15,23,28H,12-13,16H2,1H3,(H3,26,27)/t23-/m0/s1
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2.50E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080499
PNG
(3-[(S)-3-(7-Amino-naphthalene-2-sulfonylamino)-2-o...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(N)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H23N5O3S/c23-18-6-4-15-5-7-19(12-17(15)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-16(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13,23H2,(H3,24,25)/t20-/m0/s1
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2.60E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080481
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2ccnc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C22H23N5O4S/c1-31-17-4-2-15-3-5-18(12-16(15)11-17)32(29,30)26-19-7-9-27(22(19)28)13-14-6-8-25-20(10-14)21(23)24/h2-6,8,10-12,19,26H,7,9,13H2,1H3,(H3,23,24)/t19-/m0/s1
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2.84E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080477
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C22H22N4O3S/c23-21(24)18-7-3-4-15(12-18)14-26-11-10-20(22(26)27)25-30(28,29)19-9-8-16-5-1-2-6-17(16)13-19/h1-9,12-13,20,25H,10-11,14H2,(H3,23,24)/t20-/m0/s1
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2.90E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080480
PNG
(3-[(S)-3-(3'-Methoxy-biphenyl-4-sulfonylamino)-2-o...)
Show SMILES COc1cccc(c1)-c1ccc(cc1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O4S/c1-33-21-7-3-5-19(15-21)18-8-10-22(11-9-18)34(31,32)28-23-12-13-29(25(23)30)16-17-4-2-6-20(14-17)24(26)27/h2-11,14-15,23,28H,12-13,16H2,1H3,(H3,26,27)/t23-/m0/s1
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>2.90E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080508
PNG
(3-[(S)-2-Oxo-3-(4-phenoxy-benzenesulfonylamino)-py...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)C2=O)c1
Show InChI InChI=1S/C24H24N4O4S/c25-23(26)18-6-4-5-17(15-18)16-28-14-13-22(24(28)29)27-33(30,31)21-11-9-20(10-12-21)32-19-7-2-1-3-8-19/h1-12,15,22,27H,13-14,16H2,(H3,25,26)/t22-/m0/s1
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>2.90E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080494
PNG
(3-[(S)-3-(7-Hydroxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(O)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H22N4O4S/c23-21(24)16-3-1-2-14(10-16)13-26-9-8-20(22(26)28)25-31(29,30)19-7-5-15-4-6-18(27)11-17(15)12-19/h1-7,10-12,20,25,27H,8-9,13H2,(H3,23,24)/t20-/m0/s1
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>2.90E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080473
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-piper...)
Show SMILES NC(=N)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C23H24N4O3S/c24-22(25)19-8-3-5-16(13-19)15-27-12-4-9-21(23(27)28)26-31(29,30)20-11-10-17-6-1-2-7-18(17)14-20/h1-3,5-8,10-11,13-14,21,26H,4,9,12,15H2,(H3,24,25)/t21-/m0/s1
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>2.90E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM13290
PNG
(3-{[(3S)-2-oxo-3-[(4-phenylbenzene)sulfonamido]pyr...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)C2=O)c1 |r|
Show InChI InChI=1S/C24H24N4O3S/c25-23(26)20-8-4-5-17(15-20)16-28-14-13-22(24(28)29)27-32(30,31)21-11-9-19(10-12-21)18-6-2-1-3-7-18/h1-12,15,22,27H,13-14,16H2,(H3,25,26)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080495
PNG
(3-[(S)-3-(Biphenyl-3-sulfonylamino)-2-oxo-pyrrolid...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3cccc(c3)-c3ccccc3)C2=O)c1
Show InChI InChI=1S/C24H24N4O3S/c25-23(26)20-10-4-6-17(14-20)16-28-13-12-22(24(28)29)27-32(30,31)21-11-5-9-19(15-21)18-7-2-1-3-8-18/h1-11,14-15,22,27H,12-13,16H2,(H3,25,26)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080490
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-azeti...)
Show SMILES NC(=N)c1cccc(CN2C[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C21H20N4O3S/c22-20(23)17-7-3-4-14(10-17)12-25-13-19(21(25)26)24-29(27,28)18-9-8-15-5-1-2-6-16(15)11-18/h1-11,19,24H,12-13H2,(H3,22,23)/t19-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080478
PNG
(3-[3-(2-Naphthalen-2-yl-ethyl)-indol-1-ylmethyl]-b...)
Show SMILES NC(=N)c1cccc(Cn2cc(CCc3ccc4ccccc4c3)c3ccccc23)c1
Show InChI InChI=1S/C28H25N3/c29-28(30)24-9-5-6-21(17-24)18-31-19-25(26-10-3-4-11-27(26)31)15-13-20-12-14-22-7-1-2-8-23(22)16-20/h1-12,14,16-17,19H,13,15,18H2,(H3,29,30)
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2.90E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080488
PNG
(3-[(S)-3-(Naphthalene-1-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3cccc4ccccc34)C2=O)c1
Show InChI InChI=1S/C22H22N4O3S/c23-21(24)17-8-3-5-15(13-17)14-26-12-11-19(22(26)27)25-30(28,29)20-10-4-7-16-6-1-2-9-18(16)20/h1-10,13,19,25H,11-12,14H2,(H3,23,24)/t19-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080512
PNG
(5-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2ccc(o2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O5S/c1-29-15-4-2-13-3-6-17(11-14(13)10-15)31(27,28)24-18-8-9-25(21(18)26)12-16-5-7-19(30-16)20(22)23/h2-7,10-11,18,24H,8-9,12H2,1H3,(H3,22,23)/t18-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080502
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-azepa...)
Show SMILES NC(=N)c1cccc(CN2CCCC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C24H26N4O3S/c25-23(26)20-9-5-6-17(14-20)16-28-13-4-3-10-22(24(28)29)27-32(30,31)21-12-11-18-7-1-2-8-19(18)15-21/h1-2,5-9,11-12,14-15,22,27H,3-4,10,13,16H2,(H3,25,26)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080491
PNG
(3-[(S)-3-(6-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2cc(ccc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-7-5-17-13-20(8-6-16(17)12-19)32(29,30)26-21-9-10-27(23(21)28)14-15-3-2-4-18(11-15)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080484
PNG
(3-[(S)-4-(Naphthalene-2-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2C[C@H](CC2=O)NS(=O)(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H22N4O3S/c23-22(24)18-7-3-4-15(10-18)13-26-14-19(12-21(26)27)25-30(28,29)20-9-8-16-5-1-2-6-17(16)11-20/h1-11,19,25H,12-14H2,(H3,23,24)/t19-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080507
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2coc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O5S/c1-29-16-4-2-14-3-5-17(10-15(14)9-16)31(27,28)24-18-6-7-25(21(18)26)11-13-8-19(20(22)23)30-12-13/h2-5,8-10,12,18,24H,6-7,11H2,1H3,(H3,22,23)/t18-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080505
PNG
(CHEMBL324337 | [[(S)-1-(3-Carbamimidoyl-benzyl)-2-...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(CC(O)=O)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O6S/c1-35-20-7-5-17-6-8-21(13-19(17)12-20)36(33,34)29(15-23(30)31)22-9-10-28(25(22)32)14-16-3-2-4-18(11-16)24(26)27/h2-8,11-13,22H,9-10,14-15H2,1H3,(H3,26,27)(H,30,31)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080487
PNG
(3-[(S)-3-(6-Chloro-naphthalene-2-sulfonylamino)-2-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C2=O)c1
Show InChI InChI=1S/C22H21ClN4O3S/c23-18-6-4-16-12-19(7-5-15(16)11-18)31(29,30)26-20-8-9-27(22(20)28)13-14-2-1-3-17(10-14)21(24)25/h1-7,10-12,20,26H,8-9,13H2,(H3,24,25)/t20-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080483
PNG
(3-[(S)-3-(7-Ethoxy-naphthalene-2-sulfonylamino)-2-...)
Show SMILES CCOc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C24H26N4O4S/c1-2-32-20-8-6-17-7-9-21(14-19(17)13-20)33(30,31)27-22-10-11-28(24(22)29)15-16-4-3-5-18(12-16)23(25)26/h3-9,12-14,22,27H,2,10-11,15H2,1H3,(H3,25,26)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080489
PNG
(3-[(S)-3-(2'-Methoxy-biphenyl-4-sulfonylamino)-2-o...)
Show SMILES COc1ccccc1-c1ccc(cc1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O4S/c1-33-23-8-3-2-7-21(23)18-9-11-20(12-10-18)34(31,32)28-22-13-14-29(25(22)30)16-17-5-4-6-19(15-17)24(26)27/h2-12,15,22,28H,13-14,16H2,1H3,(H3,26,27)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080513
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-pyrrolidin-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H24N4O2S/c23-22(24)19-7-3-4-16(12-19)14-26-11-10-20(15-26)25-29(27,28)21-9-8-17-5-1-2-6-18(17)13-21/h1-9,12-13,20,25H,10-11,14-15H2,(H3,23,24)/t20-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080474
PNG
(3-[(S)-3-(4-Benzyl-benzenesulfonylamino)-2-oxo-pyr...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc(Cc4ccccc4)cc3)C2=O)c1
Show InChI InChI=1S/C25H26N4O3S/c26-24(27)21-8-4-7-20(16-21)17-29-14-13-23(25(29)30)28-33(31,32)22-11-9-19(10-12-22)15-18-5-2-1-3-6-18/h1-12,16,23,28H,13-15,17H2,(H3,26,27)/t23-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Trypsin II


(Bos taurus)
BDBM50080504
PNG
(3-[(S)-3-(3'-Methyl-biphenyl-4-sulfonylamino)-2-ox...)
Show SMILES Cc1cccc(c1)-c1ccc(cc1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O3S/c1-17-4-2-6-20(14-17)19-8-10-22(11-9-19)33(31,32)28-23-12-13-29(25(23)30)16-18-5-3-7-21(15-18)24(26)27/h2-11,14-15,23,28H,12-13,16H2,1H3,(H3,26,27)/t23-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic trypsin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080508
PNG
(3-[(S)-2-Oxo-3-(4-phenoxy-benzenesulfonylamino)-py...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)C2=O)c1
Show InChI InChI=1S/C24H24N4O4S/c25-23(26)18-6-4-5-17(15-18)16-28-14-13-22(24(28)29)27-33(30,31)21-11-9-20(10-12-21)32-19-7-2-1-3-8-19/h1-12,15,22,27H,13-14,16H2,(H3,25,26)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080505
PNG
(CHEMBL324337 | [[(S)-1-(3-Carbamimidoyl-benzyl)-2-...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(CC(O)=O)[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O6S/c1-35-20-7-5-17-6-8-21(13-19(17)12-20)36(33,34)29(15-23(30)31)22-9-10-28(25(22)32)14-16-3-2-4-18(11-16)24(26)27/h2-8,11-13,22H,9-10,14-15H2,1H3,(H3,26,27)(H,30,31)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080478
PNG
(3-[3-(2-Naphthalen-2-yl-ethyl)-indol-1-ylmethyl]-b...)
Show SMILES NC(=N)c1cccc(Cn2cc(CCc3ccc4ccccc4c3)c3ccccc23)c1
Show InChI InChI=1S/C28H25N3/c29-28(30)24-9-5-6-21(17-24)18-31-19-25(26-10-3-4-11-27(26)31)15-13-20-12-14-22-7-1-2-8-23(22)16-20/h1-12,14,16-17,19H,13,15,18H2,(H3,29,30)
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080474
PNG
(3-[(S)-3-(4-Benzyl-benzenesulfonylamino)-2-oxo-pyr...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc(Cc4ccccc4)cc3)C2=O)c1
Show InChI InChI=1S/C25H26N4O3S/c26-24(27)21-8-4-7-20(16-21)17-29-14-13-23(25(29)30)28-33(31,32)22-11-9-19(10-12-22)15-18-5-2-1-3-6-18/h1-12,16,23,28H,13-15,17H2,(H3,26,27)/t23-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080507
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2coc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O5S/c1-29-16-4-2-14-3-5-17(10-15(14)9-16)31(27,28)24-18-6-7-25(21(18)26)11-13-8-19(20(22)23)30-12-13/h2-5,8-10,12,18,24H,6-7,11H2,1H3,(H3,22,23)/t18-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080504
PNG
(3-[(S)-3-(3'-Methyl-biphenyl-4-sulfonylamino)-2-ox...)
Show SMILES Cc1cccc(c1)-c1ccc(cc1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O3S/c1-17-4-2-6-20(14-17)19-8-10-22(11-9-19)33(31,32)28-23-12-13-29(25(23)30)16-18-5-3-7-21(15-18)24(26)27/h2-11,14-15,23,28H,12-13,16H2,1H3,(H3,26,27)/t23-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM13290
PNG
(3-{[(3S)-2-oxo-3-[(4-phenylbenzene)sulfonamido]pyr...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc(cc3)-c3ccccc3)C2=O)c1 |r|
Show InChI InChI=1S/C24H24N4O3S/c25-23(26)20-8-4-5-17(15-20)16-28-14-13-22(24(28)29)27-32(30,31)21-11-9-19(10-12-21)18-6-2-1-3-7-18/h1-12,15,22,27H,13-14,16H2,(H3,25,26)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080489
PNG
(3-[(S)-3-(2'-Methoxy-biphenyl-4-sulfonylamino)-2-o...)
Show SMILES COc1ccccc1-c1ccc(cc1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C25H26N4O4S/c1-33-23-8-3-2-7-21(23)18-9-11-20(12-10-18)34(31,32)28-22-13-14-29(25(22)30)16-17-5-4-6-19(15-17)24(26)27/h2-12,15,22,28H,13-14,16H2,1H3,(H3,26,27)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080477
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C22H22N4O3S/c23-21(24)18-7-3-4-15(12-18)14-26-11-10-20(22(26)27)25-30(28,29)19-9-8-16-5-1-2-6-17(16)13-19/h1-9,12-13,20,25H,10-11,14H2,(H3,23,24)/t20-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080497
PNG
(3-[(S)-3-(7-Methylamino-naphthalene-2-sulfonylamin...)
Show SMILES CNc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O
Show InChI InChI=1S/C23H25N5O3S/c1-26-19-7-5-16-6-8-20(13-18(16)12-19)32(30,31)27-21-9-10-28(23(21)29)14-15-3-2-4-17(11-15)22(24)25/h2-8,11-13,21,26-27H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080502
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-azepa...)
Show SMILES NC(=N)c1cccc(CN2CCCC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C24H26N4O3S/c25-23(26)20-9-5-6-17(14-20)16-28-13-4-3-10-22(24(28)29)27-32(30,31)21-12-11-18-7-1-2-8-19(18)15-21/h1-2,5-9,11-12,14-15,22,27H,3-4,10,13,16H2,(H3,25,26)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080513
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-pyrrolidin-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H24N4O2S/c23-22(24)19-7-3-4-16(12-19)14-26-11-10-20(15-26)25-29(27,28)21-9-8-17-5-1-2-6-18(17)13-21/h1-9,12-13,20,25H,10-11,14-15H2,(H3,23,24)/t20-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080495
PNG
(3-[(S)-3-(Biphenyl-3-sulfonylamino)-2-oxo-pyrrolid...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3cccc(c3)-c3ccccc3)C2=O)c1
Show InChI InChI=1S/C24H24N4O3S/c25-23(26)20-10-4-6-17(14-20)16-28-13-12-22(24(28)29)27-32(30,31)21-11-5-9-19(15-21)18-7-2-1-3-8-18/h1-11,14-15,22,27H,12-13,16H2,(H3,25,26)/t22-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080473
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-piper...)
Show SMILES NC(=N)c1cccc(CN2CCC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C23H24N4O3S/c24-22(25)19-8-3-5-16(13-19)15-27-12-4-9-21(23(27)28)26-31(29,30)20-11-10-17-6-1-2-7-18(17)14-20/h1-3,5-8,10-11,13-14,21,26H,4,9,12,15H2,(H3,24,25)/t21-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080486
PNG
(4-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2ccc(cc2)C(N)=N)C1=O
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-8-6-16-7-9-20(13-18(16)12-19)32(29,30)26-21-10-11-27(23(21)28)14-15-2-4-17(5-3-15)22(24)25/h2-9,12-13,21,26H,10-11,14H2,1H3,(H3,24,25)/t21-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080484
PNG
(3-[(S)-4-(Naphthalene-2-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2C[C@H](CC2=O)NS(=O)(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H22N4O3S/c23-22(24)18-7-3-4-15(10-18)13-26-14-19(12-21(26)27)25-30(28,29)20-9-8-16-5-1-2-6-17(16)11-20/h1-11,19,25H,12-14H2,(H3,23,24)/t19-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080512
PNG
(5-[(S)-3-(7-Methoxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2ccc(o2)C(N)=N)C1=O
Show InChI InChI=1S/C21H22N4O5S/c1-29-15-4-2-13-3-6-17(11-14(13)10-15)31(27,28)24-18-8-9-25(21(18)26)12-16-5-7-19(30-16)20(22)23/h2-7,10-11,18,24H,8-9,12H2,1H3,(H3,22,23)/t18-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080490
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-azeti...)
Show SMILES NC(=N)c1cccc(CN2C[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C21H20N4O3S/c22-20(23)17-7-3-4-14(10-17)12-25-13-19(21(25)26)24-29(27,28)18-9-8-15-5-1-2-6-16(15)11-18/h1-11,19,24H,12-13H2,(H3,22,23)/t19-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080488
PNG
(3-[(S)-3-(Naphthalene-1-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3cccc4ccccc34)C2=O)c1
Show InChI InChI=1S/C22H22N4O3S/c23-21(24)17-8-3-5-15(13-17)14-26-12-11-19(22(26)27)25-30(28,29)20-10-4-7-16-6-1-2-9-18(16)20/h1-10,13,19,25H,11-12,14H2,(H3,23,24)/t19-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50080494
PNG
(3-[(S)-3-(7-Hydroxy-naphthalene-2-sulfonylamino)-2...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccc(O)cc4c3)C2=O)c1
Show InChI InChI=1S/C22H22N4O4S/c23-21(24)16-3-1-2-14(10-16)13-26-9-8-20(22(26)28)25-31(29,30)19-7-5-15-4-6-18(27)11-17(15)12-19/h1-7,10-12,20,25,27H,8-9,13H2,(H3,23,24)/t20-/m0/s1
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Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human thrombin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM13279
PNG
(4-{[(3S)-3-[(7-methoxynaphthalene-2-)(methyl)sulfo...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(C)[C@H]1CCN(Cc2csc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C22H24N4O4S2/c1-25(19-7-8-26(22(19)27)12-14-9-20(21(23)24)31-13-14)32(28,29)18-6-4-15-3-5-17(30-2)10-16(15)11-18/h3-6,9-11,13,19H,7-8,12H2,1-2H3,(H3,23,24)/t19-/m0/s1
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4.40E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of plasmin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50080477
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C22H22N4O3S/c23-21(24)18-7-3-4-15(12-18)14-26-11-10-20(22(26)27)25-30(28,29)19-9-8-16-5-1-2-6-17(16)13-19/h1-9,12-13,20,25H,10-11,14H2,(H3,23,24)/t20-/m0/s1
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4.70E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of plasmin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM13280
PNG
(3-{[(3S)-3-[(7-methoxynaphthalene-2-)sulfonamido]-...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-7-5-16-6-8-20(13-18(16)12-19)32(29,30)26-21-9-10-27(23(21)28)14-15-3-2-4-17(11-15)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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4.70E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of plasmin


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080502
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-azepa...)
Show SMILES NC(=N)c1cccc(CN2CCCC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C24H26N4O3S/c25-23(26)20-9-5-6-17(14-20)16-28-13-4-3-10-22(24(28)29)27-32(30,31)21-12-11-18-7-1-2-8-19(18)15-21/h1-2,5-9,11-12,14-15,22,27H,3-4,10,13,16H2,(H3,25,26)/t22-/m0/s1
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7.00E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Vitamin K-dependent protein C


(Homo sapiens (Human))
BDBM50080477
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C22H22N4O3S/c23-21(24)18-7-3-4-15(12-18)14-26-11-10-20(22(26)27)25-30(28,29)19-9-8-16-5-1-2-6-17(16)13-19/h1-9,12-13,20,25H,10-11,14H2,(H3,23,24)/t20-/m0/s1
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7.00E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Activated protein C (aPC)


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM13279
PNG
(4-{[(3S)-3-[(7-methoxynaphthalene-2-)(methyl)sulfo...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N(C)[C@H]1CCN(Cc2csc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C22H24N4O4S2/c1-25(19-7-8-26(22(19)27)12-14-9-20(21(23)24)31-13-14)32(28,29)18-6-4-15-3-5-17(30-2)10-16(15)11-18/h3-6,9-11,13,19H,7-8,12H2,1-2H3,(H3,23,24)/t19-/m0/s1
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8.60E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Tissue type plasminogen activator (tissue plasminogen activator)


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080484
PNG
(3-[(S)-4-(Naphthalene-2-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2C[C@H](CC2=O)NS(=O)(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H22N4O3S/c23-22(24)18-7-3-4-15(10-18)13-26-14-19(12-21(26)27)25-30(28,29)20-9-8-16-5-1-2-6-17(16)11-20/h1-11,19,25H,12-14H2,(H3,23,24)/t19-/m0/s1
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9.80E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080490
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-azeti...)
Show SMILES NC(=N)c1cccc(CN2C[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C21H20N4O3S/c22-20(23)17-7-3-4-14(10-17)12-25-13-19(21(25)26)24-29(27,28)18-9-8-15-5-1-2-6-16(15)11-18/h1-11,19,24H,12-13H2,(H3,22,23)/t19-/m0/s1
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9.90E+3n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM13280
PNG
(3-{[(3S)-3-[(7-methoxynaphthalene-2-)sulfonamido]-...)
Show SMILES COc1ccc2ccc(cc2c1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O |r|
Show InChI InChI=1S/C23H24N4O4S/c1-31-19-7-5-16-6-8-20(13-18(16)12-19)32(29,30)26-21-9-10-27(23(21)28)14-15-3-2-4-17(11-15)22(24)25/h2-8,11-13,21,26H,9-10,14H2,1H3,(H3,24,25)/t21-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Tissue type plasminogen activator (tissue plasminogen activator)


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))
BDBM50080513
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-pyrrolidin-...)
Show SMILES NC(=N)c1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H24N4O2S/c23-22(24)19-7-3-4-16(12-19)14-26-11-10-20(15-26)25-29(27,28)21-9-8-17-5-1-2-6-18(17)13-21/h1-9,12-13,20,25H,10-11,14-15H2,(H3,23,24)/t20-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of human Coagulation factor Xa


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))
BDBM50080477
PNG
(3-[(S)-3-(Naphthalene-2-sulfonylamino)-2-oxo-pyrro...)
Show SMILES NC(=N)c1cccc(CN2CC[C@H](NS(=O)(=O)c3ccc4ccccc4c3)C2=O)c1
Show InChI InChI=1S/C22H22N4O3S/c23-21(24)18-7-3-4-15(12-18)14-26-11-10-20(22(26)27)25-30(28,29)19-9-8-16-5-1-2-6-17(16)13-19/h1-9,12-13,20,25H,10-11,14H2,(H3,23,24)/t20-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



Rh£ne-Poulenc Rorer

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of Tissue type plasminogen activator (tissue plasminogen activator)


J Med Chem 42: 3557-71 (1999)


Article DOI: 10.1021/jm990040h
BindingDB Entry DOI: 10.7270/Q2M04640
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%