Found 22 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Prothrombin
(Homo sapiens (Human)) | BDBM50290019
((3S,6S,9aS)-6-(3-Methyl-1,2,3,4-tetrahydro-quinoli...)Show SMILES CC1CNc2c(C1)cccc2S(=O)(=O)N[C@H]1CCC[C@H]2CC[C@H](N2C1=O)C(=O)N[C@H]1CCCN(C1O)C(N)=N |r| Show InChI InChI=1S/C26H39N7O5S/c1-15-13-16-5-2-9-21(22(16)29-14-15)39(37,38)31-19-7-3-6-17-10-11-20(33(17)25(19)36)23(34)30-18-8-4-12-32(24(18)35)26(27)28/h2,5,9,15,17-20,24,29,31,35H,3-4,6-8,10-14H2,1H3,(H3,27,28)(H,30,34)/t15?,17-,18-,19-,20-,24?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of human alpha Thrombin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Serine protease 1
(Bos taurus (bovine)) | BDBM50060000
((S)-1-((R)-2-Methylamino-2-phenyl-acetyl)-pyrrolid...)Show SMILES CN[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C=O)c1ccccc1 Show InChI InChI=1S/C20H30N6O3/c1-23-17(14-7-3-2-4-8-14)19(29)26-12-6-10-16(26)18(28)25-15(13-27)9-5-11-24-20(21)22/h2-4,7-8,13,15-17,23H,5-6,9-12H2,1H3,(H,25,28)(H4,21,22,24)/t15-,16-,17+/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Trypsin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM50060000
((S)-1-((R)-2-Methylamino-2-phenyl-acetyl)-pyrrolid...)Show SMILES CN[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C=O)c1ccccc1 Show InChI InChI=1S/C20H30N6O3/c1-23-17(14-7-3-2-4-8-14)19(29)26-12-6-10-16(26)18(28)25-15(13-27)9-5-11-24-20(21)22/h2-4,7-8,13,15-17,23H,5-6,9-12H2,1H3,(H,25,28)(H4,21,22,24)/t15-,16-,17+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
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| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of human alpha Thrombin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM50038001
((2R,4R)-1-((S)-5-(diaminomethyleneamino)-2-(3-meth...)Show SMILES C[C@@H]1CCN([C@H](C1)C(O)=O)C(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)c1cccc2CC(C)CNc12 Show InChI InChI=1S/C23H36N6O5S/c1-14-8-10-29(18(12-14)22(31)32)21(30)17(6-4-9-26-23(24)25)28-35(33,34)19-7-3-5-16-11-15(2)13-27-20(16)19/h3,5,7,14-15,17-18,27-28H,4,6,8-13H2,1-2H3,(H,31,32)(H4,24,25,26)/t14-,15?,17+,18-/m1/s1 | PDB
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| Article
| n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of human alpha Thrombin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Serine protease 1
(Bos taurus (bovine)) | BDBM50290019
((3S,6S,9aS)-6-(3-Methyl-1,2,3,4-tetrahydro-quinoli...)Show SMILES CC1CNc2c(C1)cccc2S(=O)(=O)N[C@H]1CCC[C@H]2CC[C@H](N2C1=O)C(=O)N[C@H]1CCCN(C1O)C(N)=N |r| Show InChI InChI=1S/C26H39N7O5S/c1-15-13-16-5-2-9-21(22(16)29-14-15)39(37,38)31-19-7-3-6-17-10-11-20(33(17)25(19)36)23(34)30-18-8-4-12-32(24(18)35)26(27)28/h2,5,9,15,17-20,24,29,31,35H,3-4,6-8,10-14H2,1H3,(H3,27,28)(H,30,34)/t15?,17-,18-,19-,20-,24?/m0/s1 | PDB
MMDB
KEGG
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B.MOAD
DrugBank
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| CHEMBL
PC cid
PC sid
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| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Trypsin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM50290022
((3S,6S,9aS)-5-Oxo-6-phenylmethanesulfonylamino-oct...)Show SMILES NC(=N)N1CCC[C@H](NC(=O)[C@@H]2CC[C@@H]3CCC[C@H](NS(=O)(=O)Cc4ccccc4)C(=O)N23)C1O |r| Show InChI InChI=1S/C23H34N6O5S/c24-23(25)28-13-5-10-17(21(28)31)26-20(30)19-12-11-16-8-4-9-18(22(32)29(16)19)27-35(33,34)14-15-6-2-1-3-7-15/h1-3,6-7,16-19,21,27,31H,4-5,8-14H2,(H3,24,25)(H,26,30)/t16-,17-,18-,19-,21?/m0/s1 | PDB
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| CHEMBL
PC cid
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| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of human alpha Thrombin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM50290021
((3S,6S,9aS)-6-(Naphthalene-1-sulfonylamino)-5-oxo-...)Show SMILES NC(=N)N1CCC[C@H](NC(=O)[C@@H]2CC[C@@H]3CCC[C@H](NS(=O)(=O)c4cccc5ccccc45)C(=O)N23)C1O Show InChI InChI=1S/C26H34N6O5S/c27-26(28)31-15-5-11-19(24(31)34)29-23(33)21-14-13-17-8-4-10-20(25(35)32(17)21)30-38(36,37)22-12-3-7-16-6-1-2-9-18(16)22/h1-3,6-7,9,12,17,19-21,24,30,34H,4-5,8,10-11,13-15H2,(H3,27,28)(H,29,33)/t17-,19-,20-,21-,24?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of human alpha Thrombin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Plasminogen
(Homo sapiens (Human)) | BDBM50060000
((S)-1-((R)-2-Methylamino-2-phenyl-acetyl)-pyrrolid...)Show SMILES CN[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C=O)c1ccccc1 Show InChI InChI=1S/C20H30N6O3/c1-23-17(14-7-3-2-4-8-14)19(29)26-12-6-10-16(26)18(28)25-15(13-27)9-5-11-24-20(21)22/h2-4,7-8,13,15-17,23H,5-6,9-12H2,1H3,(H,25,28)(H4,21,22,24)/t15-,16-,17+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
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DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Plasmin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Plasminogen
(Homo sapiens (Human)) | BDBM50290019
((3S,6S,9aS)-6-(3-Methyl-1,2,3,4-tetrahydro-quinoli...)Show SMILES CC1CNc2c(C1)cccc2S(=O)(=O)N[C@H]1CCC[C@H]2CC[C@H](N2C1=O)C(=O)N[C@H]1CCCN(C1O)C(N)=N |r| Show InChI InChI=1S/C26H39N7O5S/c1-15-13-16-5-2-9-21(22(16)29-14-15)39(37,38)31-19-7-3-6-17-10-11-20(33(17)25(19)36)23(34)30-18-8-4-12-32(24(18)35)26(27)28/h2,5,9,15,17-20,24,29,31,35H,3-4,6-8,10-14H2,1H3,(H3,27,28)(H,30,34)/t15?,17-,18-,19-,20-,24?/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.04E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Plasmin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM50290017
((3S,9aS)-6-Benzyl-5-oxo-octahydro-pyrrolo[1,2-a]az...)Show SMILES NC(=N)N1CCC[C@H](NC(=O)[C@@H]2CC[C@@H]3CCCC(Cc4ccccc4)C(=O)N23)C1O Show InChI InChI=1S/C23H33N5O3/c24-23(25)27-13-5-10-18(22(27)31)26-20(29)19-12-11-17-9-4-8-16(21(30)28(17)19)14-15-6-2-1-3-7-15/h1-3,6-7,16-19,22,31H,4-5,8-14H2,(H3,24,25)(H,26,29)/t16?,17-,18-,19-,22?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of human alpha Thrombin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM50290020
((S)-1-Phenylacetyl-pyrrolidine-2-carboxylic acid (...)Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)C=O Show InChI InChI=1S/C19H27N5O3/c20-19(21)22-10-4-8-15(13-25)23-18(27)16-9-5-11-24(16)17(26)12-14-6-2-1-3-7-14/h1-3,6-7,13,15-16H,4-5,8-12H2,(H,23,27)(H4,20,21,22)/t15-,16-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
| n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of human alpha Thrombin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM50450514
(CHEMBL2304270)Show SMILES Cl.[H][C@]12CC[C@H](N1C(=O)[C@](Cc1ccccc1)(CC2)NC(C)=O)C(=O)N[C@H]1CCCN(C1O)C(N)=N |r| Show InChI InChI=1S/C24H34N6O4.ClH/c1-15(31)28-24(14-16-6-3-2-4-7-16)12-11-17-9-10-19(30(17)22(24)34)20(32)27-18-8-5-13-29(21(18)33)23(25)26;/h2-4,6-7,17-19,21,33H,5,8-14H2,1H3,(H3,25,26)(H,27,32)(H,28,31);1H/t17-,18+,19+,21?,24-;/m1./s1 | PDB
UniProtKB/SwissProt
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 3.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of human alpha Thrombin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM50290018
((3S,6S,9aS)-6-Acetylamino-5-oxo-octahydro-pyrrolo[...)Show SMILES CC(=O)N[C@H]1CCC[C@H]2CC[C@H](N2C1=O)C(=O)N[C@H]1CCCN(C1O)C(N)=N |r| Show InChI InChI=1S/C18H30N6O4/c1-10(25)21-13-5-2-4-11-7-8-14(24(11)17(13)28)15(26)22-12-6-3-9-23(16(12)27)18(19)20/h11-14,16,27H,2-9H2,1H3,(H3,19,20)(H,21,25)(H,22,26)/t11-,12-,13-,14-,16?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
| Article
| n/a | n/a | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of human alpha Thrombin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM50290024
((3S,8aS)-6-Benzyl-5-oxo-octahydro-indolizine-3-car...)Show SMILES NC(=N)N1CCC[C@H](NC(=O)[C@@H]2CC[C@@H]3CCC(Cc4ccccc4)C(=O)N23)C1O |r| Show InChI InChI=1S/C22H31N5O3/c23-22(24)26-12-4-7-17(21(26)30)25-19(28)18-11-10-16-9-8-15(20(29)27(16)18)13-14-5-2-1-3-6-14/h1-3,5-6,15-18,21,30H,4,7-13H2,(H3,23,24)(H,25,28)/t15?,16-,17-,18-,21?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 4.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of human alpha Thrombin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Serine protease 1
(Bos taurus (bovine)) | BDBM50038001
((2R,4R)-1-((S)-5-(diaminomethyleneamino)-2-(3-meth...)Show SMILES C[C@@H]1CCN([C@H](C1)C(O)=O)C(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)c1cccc2CC(C)CNc12 Show InChI InChI=1S/C23H36N6O5S/c1-14-8-10-29(18(12-14)22(31)32)21(30)17(6-4-9-26-23(24)25)28-35(33,34)19-7-3-5-16-11-15(2)13-27-20(16)19/h3,5,7,14-15,17-18,27-28H,4,6,8-13H2,1-2H3,(H,31,32)(H4,24,25,26)/t14-,15?,17+,18-/m1/s1 | PDB
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CHEMBL
MCE
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UniChem
Patents
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| Article
| n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Trypsin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Serine protease 1
(Bos taurus (bovine)) | BDBM50290020
((S)-1-Phenylacetyl-pyrrolidine-2-carboxylic acid (...)Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)C=O Show InChI InChI=1S/C19H27N5O3/c20-19(21)22-10-4-8-15(13-25)23-18(27)16-9-5-11-24(16)17(26)12-14-6-2-1-3-7-14/h1-3,6-7,13,15-16H,4-5,8-12H2,(H,23,27)(H4,20,21,22)/t15-,16-/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
| n/a | n/a | 7.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Trypsin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Plasminogen
(Homo sapiens (Human)) | BDBM50290021
((3S,6S,9aS)-6-(Naphthalene-1-sulfonylamino)-5-oxo-...)Show SMILES NC(=N)N1CCC[C@H](NC(=O)[C@@H]2CC[C@@H]3CCC[C@H](NS(=O)(=O)c4cccc5ccccc45)C(=O)N23)C1O Show InChI InChI=1S/C26H34N6O5S/c27-26(28)31-15-5-11-19(24(31)34)29-23(33)21-14-13-17-8-4-10-20(25(35)32(17)21)30-38(36,37)22-12-3-7-16-6-1-2-9-18(16)22/h1-3,6-7,9,12,17,19-21,24,30,34H,4-5,8,10-11,13-15H2,(H3,27,28)(H,29,33)/t17-,19-,20-,21-,24?/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
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DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Plasmin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Plasminogen
(Homo sapiens (Human)) | BDBM50290022
((3S,6S,9aS)-5-Oxo-6-phenylmethanesulfonylamino-oct...)Show SMILES NC(=N)N1CCC[C@H](NC(=O)[C@@H]2CC[C@@H]3CCC[C@H](NS(=O)(=O)Cc4ccccc4)C(=O)N23)C1O |r| Show InChI InChI=1S/C23H34N6O5S/c24-23(25)28-13-5-10-17(21(28)31)26-20(30)19-12-11-16-8-4-9-18(22(32)29(16)19)27-35(33,34)14-15-6-2-1-3-7-15/h1-3,6-7,16-19,21,27,31H,4-5,8-14H2,(H3,24,25)(H,26,30)/t16-,17-,18-,19-,21?/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Plasmin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Serine protease 1
(Bos taurus (bovine)) | BDBM50290018
((3S,6S,9aS)-6-Acetylamino-5-oxo-octahydro-pyrrolo[...)Show SMILES CC(=O)N[C@H]1CCC[C@H]2CC[C@H](N2C1=O)C(=O)N[C@H]1CCCN(C1O)C(N)=N |r| Show InChI InChI=1S/C18H30N6O4/c1-10(25)21-13-5-2-4-11-7-8-14(24(11)17(13)28)15(26)22-12-6-3-9-23(16(12)27)18(19)20/h11-14,16,27H,2-9H2,1H3,(H3,19,20)(H,21,25)(H,22,26)/t11-,12-,13-,14-,16?/m0/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
| n/a | n/a | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Trypsin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Plasminogen
(Homo sapiens (Human)) | BDBM50290020
((S)-1-Phenylacetyl-pyrrolidine-2-carboxylic acid (...)Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)C=O Show InChI InChI=1S/C19H27N5O3/c20-19(21)22-10-4-8-15(13-25)23-18(27)16-9-5-11-24(16)17(26)12-14-6-2-1-3-7-14/h1-3,6-7,13,15-16H,4-5,8-12H2,(H,23,27)(H4,20,21,22)/t15-,16-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
| n/a | n/a | 4.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Plasmin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Plasminogen
(Homo sapiens (Human)) | BDBM50290018
((3S,6S,9aS)-6-Acetylamino-5-oxo-octahydro-pyrrolo[...)Show SMILES CC(=O)N[C@H]1CCC[C@H]2CC[C@H](N2C1=O)C(=O)N[C@H]1CCCN(C1O)C(N)=N |r| Show InChI InChI=1S/C18H30N6O4/c1-10(25)21-13-5-2-4-11-7-8-14(24(11)17(13)28)15(26)22-12-6-3-9-23(16(12)27)18(19)20/h11-14,16,27H,2-9H2,1H3,(H3,19,20)(H,21,25)(H,22,26)/t11-,12-,13-,14-,16?/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
| n/a | n/a | 7.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Plasmin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
Plasminogen
(Homo sapiens (Human)) | BDBM50038001
((2R,4R)-1-((S)-5-(diaminomethyleneamino)-2-(3-meth...)Show SMILES C[C@@H]1CCN([C@H](C1)C(O)=O)C(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)c1cccc2CC(C)CNc12 Show InChI InChI=1S/C23H36N6O5S/c1-14-8-10-29(18(12-14)22(31)32)21(30)17(6-4-9-26-23(24)25)28-35(33,34)19-7-3-5-16-11-15(2)13-27-20(16)19/h3,5,7,14-15,17-18,27-28H,4,6,8-13H2,1-2H3,(H,31,32)(H4,24,25,26)/t14-,15?,17+,18-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
KEGG
PC cid
PC sid
UniChem
Patents
Similars
| Article
| n/a | n/a | 8.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
In vitro ability to inhibit the activity of Plasmin |
Bioorg Med Chem Lett 7: 2205-2210 (1997)
Article DOI: 10.1016/S0960-894X(97)00403-4
BindingDB Entry DOI: 10.7270/Q21G0MR2 |
More data for this
Ligand-Target Pair | |
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