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PubMed code 9873411

Compile data set for download or QSAR
Found 103 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
Prothrombin


(Homo sapiens (Human))		BDBM50215570
PNG
(CHEMBL2372732)
Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-c1cc(-[#8])ccc1-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O
Show InChI InChI=1S/C34H50N8O8/c1-3-20(2)28(42-30(46)24(12-7-8-16-35)39-29(45)23-19-22(43)14-15-27(23)44)32(48)41-26(18-21-10-5-4-6-11-21)31(47)40-25(33(49)50)13-9-17-38-34(36)37/h4-6,10-11,14-15,19-20,24-26,28,43-44H,3,7-9,12-13,16-18,35H2,1-2H3,(H,39,45)(H,40,47)(H,41,48)(H,42,46)(H,49,50)(H4,36,37,38)/t20-,24-,25-,26-,28-/m0/s1
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n/an/a 1.90E+3n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070747
PNG
(CHEMBL2372735 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(O)=O
Show InChI InChI=1S/C34H50N6O8/c1-3-21(2)29(40-31(44)25(13-7-9-17-35)37-30(43)24-20-23(41)15-16-28(24)42)33(46)39-27(19-22-11-5-4-6-12-22)32(45)38-26(34(47)48)14-8-10-18-36/h4-6,11-12,15-16,20-21,25-27,29,41-42H,3,7-10,13-14,17-19,35-36H2,1-2H3,(H,37,43)(H,38,45)(H,39,46)(H,40,44)(H,47,48)/t21?,25-,26-,27-,29-/m0/s1
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n/an/a 2.50E+3n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070757
PNG
(CHEMBL2372733 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(O)=O
Show InChI InChI=1S/C31H43N5O8/c1-4-18(2)26(30(42)35-24(16-20-10-6-5-7-11-20)29(41)33-19(3)31(43)44)36-28(40)23(12-8-9-15-32)34-27(39)22-17-21(37)13-14-25(22)38/h5-7,10-11,13-14,17-19,23-24,26,37-38H,4,8-9,12,15-16,32H2,1-3H3,(H,33,41)(H,34,39)(H,35,42)(H,36,40)(H,43,44)/t18?,19-,23+,24+,26+/m1/s1
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n/an/a 5.80E+3n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070767
PNG
(CHEMBL2372663 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(O)=O
Show InChI InChI=1S/C33H46N6O9/c1-3-19(2)28(39-30(44)23(11-7-8-16-34)36-29(43)22-18-21(40)12-14-26(22)41)32(46)38-25(17-20-9-5-4-6-10-20)31(45)37-24(33(47)48)13-15-27(35)42/h4-6,9-10,12,14,18-19,23-25,28,40-41H,3,7-8,11,13,15-17,34H2,1-2H3,(H2,35,42)(H,36,43)(H,37,45)(H,38,46)(H,39,44)(H,47,48)/t19?,23-,24-,25-,28-/m0/s1
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n/an/a 6.40E+3n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070713
PNG
(CHEMBL2372657 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(O)=O
Show InChI InChI=1S/C33H47N5O8S/c1-4-20(2)28(38-30(42)24(12-8-9-16-34)35-29(41)23-19-22(39)13-14-27(23)40)32(44)37-26(18-21-10-6-5-7-11-21)31(43)36-25(33(45)46)15-17-47-3/h5-7,10-11,13-14,19-20,24-26,28,39-40H,4,8-9,12,15-18,34H2,1-3H3,(H,35,41)(H,36,43)(H,37,44)(H,38,42)(H,45,46)/t20?,24-,25-,26-,28-/m0/s1
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n/an/a 7.00E+3n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070730
PNG
(CHEMBL2372736 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C34H49N5O8/c1-5-21(4)29(39-31(43)25(13-9-10-16-35)36-30(42)24-19-23(40)14-15-28(24)41)33(45)37-26(18-22-11-7-6-8-12-22)32(44)38-27(34(46)47)17-20(2)3/h6-8,11-12,14-15,19-21,25-27,29,40-41H,5,9-10,13,16-18,35H2,1-4H3,(H,36,42)(H,37,45)(H,38,44)(H,39,43)(H,46,47)/t21?,25-,26-,27+,29-/m0/s1
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n/an/a 9.00E+3n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070681
PNG
(CHEMBL2372666 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(O)=O
Show InChI InChI=1S/C32H45N5O8/c1-3-20(2)28(32(45)36-25(18-21-10-5-4-6-11-21)30(43)34-17-9-13-27(40)41)37-31(44)24(12-7-8-16-33)35-29(42)23-19-22(38)14-15-26(23)39/h4-6,10-11,14-15,19-20,24-25,28,38-39H,3,7-9,12-13,16-18,33H2,1-2H3,(H,34,43)(H,35,42)(H,36,45)(H,37,44)(H,40,41)/t20?,24-,25-,28-/m0/s1
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n/an/a 1.10E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070774
PNG
(CHEMBL2372697 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCCCC(O)=O
Show InChI InChI=1S/C34H49N5O8/c1-3-22(2)30(39-33(46)26(14-9-10-18-35)37-31(44)25-21-24(40)16-17-28(25)41)34(47)38-27(20-23-12-6-4-7-13-23)32(45)36-19-11-5-8-15-29(42)43/h4,6-7,12-13,16-17,21-22,26-27,30,40-41H,3,5,8-11,14-15,18-20,35H2,1-2H3,(H,36,45)(H,37,44)(H,38,47)(H,39,46)(H,42,43)/t22?,26-,27-,30-/m0/s1
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n/an/a 1.30E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070704
PNG
(CHEMBL2372686 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(O)=O
Show InChI InChI=1S/C34H45N7O8/c1-3-20(2)29(41-31(45)25(11-7-8-14-35)38-30(44)24-17-23(42)12-13-28(24)43)33(47)39-26(15-21-9-5-4-6-10-21)32(46)40-27(34(48)49)16-22-18-36-19-37-22/h4-6,9-10,12-13,17-20,25-27,29,42-43H,3,7-8,11,14-16,35H2,1-2H3,(H,36,37)(H,38,44)(H,39,47)(H,40,46)(H,41,45)(H,48,49)/t20?,25-,26-,27-,29-/m0/s1
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n/an/a 1.30E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070729
PNG
(CHEMBL2372758 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC)C(O)=O
Show InChI InChI=1S/C32H45N5O8/c1-4-19(3)27(31(43)36-25(17-20-11-7-6-8-12-20)30(42)34-23(5-2)32(44)45)37-29(41)24(13-9-10-16-33)35-28(40)22-18-21(38)14-15-26(22)39/h6-8,11-12,14-15,18-19,23-25,27,38-39H,4-5,9-10,13,16-17,33H2,1-3H3,(H,34,42)(H,35,40)(H,36,43)(H,37,41)(H,44,45)/t19?,23-,24+,25+,27+/m1/s1
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n/an/a 1.40E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070726
PNG
(CHEMBL2372710 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(O)=O
Show InChI InChI=1S/C31H43N5O9/c1-3-18(2)26(30(43)34-23(15-19-9-5-4-6-10-19)29(42)35-24(17-37)31(44)45)36-28(41)22(11-7-8-14-32)33-27(40)21-16-20(38)12-13-25(21)39/h4-6,9-10,12-13,16,18,22-24,26,37-39H,3,7-8,11,14-15,17,32H2,1-2H3,(H,33,40)(H,34,43)(H,35,42)(H,36,41)(H,44,45)/t18?,22-,23-,24-,26-/m0/s1
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n/an/a 1.50E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070753
PNG
(CHEMBL2372726 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(O)=O
Show InChI InChI=1S/C32H45N5O9/c1-4-18(2)26(36-29(42)23(12-8-9-15-33)34-28(41)22-17-21(39)13-14-25(22)40)31(44)35-24(16-20-10-6-5-7-11-20)30(43)37-27(19(3)38)32(45)46/h5-7,10-11,13-14,17-19,23-24,26-27,38-40H,4,8-9,12,15-16,33H2,1-3H3,(H,34,41)(H,35,44)(H,36,42)(H,37,43)(H,45,46)/t18?,19?,23-,24-,26-,27-/m0/s1
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n/an/a 1.70E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070687
PNG
(CHEMBL2372687 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(O)=O
Show InChI InChI=1S/C30H41N5O8/c1-3-18(2)26(30(43)34-23(28(41)32-17-25(38)39)15-19-9-5-4-6-10-19)35-29(42)22(11-7-8-14-31)33-27(40)21-16-20(36)12-13-24(21)37/h4-6,9-10,12-13,16,18,22-23,26,36-37H,3,7-8,11,14-15,17,31H2,1-2H3,(H,32,41)(H,33,40)(H,34,43)(H,35,42)(H,38,39)/t18?,22-,23-,26-/m0/s1
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n/an/a 2.00E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070703
PNG
(CHEMBL2372674 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C32H45N5O8/c1-4-19(3)27(31(43)36-25(17-20-11-7-6-8-12-20)30(42)34-23(5-2)32(44)45)37-29(41)24(13-9-10-16-33)35-28(40)22-18-21(38)14-15-26(22)39/h6-8,11-12,14-15,18-19,23-25,27,38-39H,4-5,9-10,13,16-17,33H2,1-3H3,(H,34,42)(H,35,40)(H,36,43)(H,37,41)(H,44,45)/t19?,23?,24-,25-,27-/m0/s1
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n/an/a 2.10E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070765
PNG
(CHEMBL2372665 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(O)=O
Show InChI InChI=1S/C32H44N6O9/c1-3-18(2)27(38-29(43)22(11-7-8-14-33)35-28(42)21-16-20(39)12-13-25(21)40)31(45)36-23(15-19-9-5-4-6-10-19)30(44)37-24(32(46)47)17-26(34)41/h4-6,9-10,12-13,16,18,22-24,27,39-40H,3,7-8,11,14-15,17,33H2,1-2H3,(H2,34,41)(H,35,42)(H,36,45)(H,37,44)(H,38,43)(H,46,47)/t18?,22-,23-,24-,27-/m0/s1
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n/an/a 2.10E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070703
PNG
(CHEMBL2372674 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C32H45N5O8/c1-4-19(3)27(31(43)36-25(17-20-11-7-6-8-12-20)30(42)34-23(5-2)32(44)45)37-29(41)24(13-9-10-16-33)35-28(40)22-18-21(38)14-15-26(22)39/h6-8,11-12,14-15,18-19,23-25,27,38-39H,4-5,9-10,13,16-17,33H2,1-3H3,(H,34,42)(H,35,40)(H,36,43)(H,37,41)(H,44,45)/t19?,23?,24-,25-,27-/m0/s1
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n/an/a 2.10E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070739
PNG
(CHEMBL2372753 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@H](C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H48N6O8/c1-4-17(3)24(28(41)34-21(10-6-8-14-30)26(39)32-20(5-2)29(42)43)35-27(40)22(11-7-9-15-31)33-25(38)19-16-18(36)12-13-23(19)37/h12-13,16-17,20-22,24,36-37H,4-11,14-15,30-31H2,1-3H3,(H,32,39)(H,33,38)(H,34,41)(H,35,40)(H,42,43)/t17?,20?,21-,22-,24-/m0/s1
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n/an/a 2.50E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070739
PNG
(CHEMBL2372753 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@H](C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H48N6O8/c1-4-17(3)24(28(41)34-21(10-6-8-14-30)26(39)32-20(5-2)29(42)43)35-27(40)22(11-7-9-15-31)33-25(38)19-16-18(36)12-13-23(19)37/h12-13,16-17,20-22,24,36-37H,4-11,14-15,30-31H2,1-3H3,(H,32,39)(H,33,38)(H,34,41)(H,35,40)(H,42,43)/t17?,20?,21-,22-,24-/m0/s1
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n/an/a 2.50E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070699
PNG
(CHEMBL2372723 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C32H45N5O9/c1-4-18(3)27(37-29(42)24(8-6-7-15-33)35-28(41)22-17-21(39)13-14-26(22)40)31(44)36-25(16-19-9-11-20(38)12-10-19)30(43)34-23(5-2)32(45)46/h9-14,17-18,23-25,27,38-40H,4-8,15-16,33H2,1-3H3,(H,34,43)(H,35,41)(H,36,44)(H,37,42)(H,45,46)/t18?,23?,24-,25-,27-/m0/s1
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n/an/a 2.50E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50215703
PNG
(CHEMBL2372746)
Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-c1cc(-[#8])ccc1-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6])-[#6](-[#8])=O
Show InChI InChI=1S/C29H48N8O8/c1-4-16(3)23(27(43)36-21(10-8-14-33-29(31)32)25(41)34-19(5-2)28(44)45)37-26(42)20(9-6-7-13-30)35-24(40)18-15-17(38)11-12-22(18)39/h11-12,15-16,19-21,23,38-39H,4-10,13-14,30H2,1-3H3,(H,34,41)(H,35,40)(H,36,43)(H,37,42)(H,44,45)(H4,31,32,33)/t16-,19-,20-,21-,23-/m0/s1
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n/an/a 2.60E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070761
PNG
(CHEMBL2372656 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C37H47N5O8/c1-3-23(2)32(42-34(46)28(16-10-11-19-38)39-33(45)27-22-26(43)17-18-31(27)44)36(48)40-29(20-24-12-6-4-7-13-24)35(47)41-30(37(49)50)21-25-14-8-5-9-15-25/h4-9,12-15,17-18,22-23,28-30,32,43-44H,3,10-11,16,19-21,38H2,1-2H3,(H,39,45)(H,40,48)(H,41,47)(H,42,46)(H,49,50)/t23?,28-,29-,30-,32-/m0/s1
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n/an/a 2.70E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070776
PNG
(CHEMBL2372751 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCC(O)=O
Show InChI InChI=1S/C31H43N5O8/c1-3-19(2)27(31(44)35-24(17-20-9-5-4-6-10-20)29(42)33-16-14-26(39)40)36-30(43)23(11-7-8-15-32)34-28(41)22-18-21(37)12-13-25(22)38/h4-6,9-10,12-13,18-19,23-24,27,37-38H,3,7-8,11,14-17,32H2,1-2H3,(H,33,42)(H,34,41)(H,35,44)(H,36,43)(H,39,40)/t19?,23-,24-,27-/m0/s1
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n/an/a 2.90E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070770
PNG
(CHEMBL2372684 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C(C)C)C(O)=O
Show InChI InChI=1S/C33H47N5O8/c1-5-20(4)28(38-30(42)24(13-9-10-16-34)35-29(41)23-18-22(39)14-15-26(23)40)32(44)36-25(17-21-11-7-6-8-12-21)31(43)37-27(19(2)3)33(45)46/h6-8,11-12,14-15,18-20,24-25,27-28,39-40H,5,9-10,13,16-17,34H2,1-4H3,(H,35,41)(H,36,44)(H,37,43)(H,38,42)(H,45,46)/t20?,24-,25-,27-,28-/m0/s1
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n/an/a 3.10E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070717
PNG
(CHEMBL2372685 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C37H47N5O9/c1-3-22(2)32(42-34(47)28(11-7-8-18-38)39-33(46)27-21-26(44)16-17-31(27)45)36(49)40-29(19-23-9-5-4-6-10-23)35(48)41-30(37(50)51)20-24-12-14-25(43)15-13-24/h4-6,9-10,12-17,21-22,28-30,32,43-45H,3,7-8,11,18-20,38H2,1-2H3,(H,39,46)(H,40,49)(H,41,48)(H,42,47)(H,50,51)/t22?,28-,29-,30-,32-/m0/s1
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n/an/a 3.80E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070768
PNG
(CHEMBL2372737 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)[C@@H](C)CC)C(O)=O
Show InChI InChI=1S/C34H49N5O8/c1-5-20(3)28(38-31(43)25(14-10-11-17-35)36-30(42)24-19-23(40)15-16-27(24)41)33(45)37-26(18-22-12-8-7-9-13-22)32(44)39-29(34(46)47)21(4)6-2/h7-9,12-13,15-16,19-21,25-26,28-29,40-41H,5-6,10-11,14,17-18,35H2,1-4H3,(H,36,42)(H,37,45)(H,38,43)(H,39,44)(H,46,47)/t20?,21?,25-,26-,28-,29-/m0/s1
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n/an/a 4.20E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070744
PNG
(CHEMBL2372725 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C39H48N6O8/c1-3-23(2)34(45-36(49)30(15-9-10-18-40)42-35(48)28-21-26(46)16-17-33(28)47)38(51)43-31(19-24-11-5-4-6-12-24)37(50)44-32(39(52)53)20-25-22-41-29-14-8-7-13-27(25)29/h4-8,11-14,16-17,21-23,30-32,34,41,46-47H,3,9-10,15,18-20,40H2,1-2H3,(H,42,48)(H,43,51)(H,44,50)(H,45,49)(H,52,53)/t23?,30-,31-,32-,34-/m0/s1
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n/an/a 4.30E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070758
PNG
(CHEMBL2372724 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C34H46N6O8/c1-4-19(3)29(40-31(44)26(12-8-9-15-35)38-30(43)23-17-21(41)13-14-28(23)42)33(46)39-27(32(45)37-24(5-2)34(47)48)16-20-18-36-25-11-7-6-10-22(20)25/h6-7,10-11,13-14,17-19,24,26-27,29,36,41-42H,4-5,8-9,12,15-16,35H2,1-3H3,(H,37,45)(H,38,43)(H,39,46)(H,40,44)(H,47,48)/t19?,24?,26-,27-,29-/m0/s1
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n/an/a 4.40E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070777
PNG
(CHEMBL2372695 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H47N5O8/c1-6-17(5)24(28(40)33-22(14-16(3)4)27(39)31-20(7-2)29(41)42)34-26(38)21(10-8-9-13-30)32-25(37)19-15-18(35)11-12-23(19)36/h11-12,15-17,20-22,24,35-36H,6-10,13-14,30H2,1-5H3,(H,31,39)(H,32,37)(H,33,40)(H,34,38)(H,41,42)/t17?,20?,21-,22+,24-/m0/s1
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n/an/a 4.60E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070738
PNG
(CHEMBL2372702 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H45N5O8S/c1-5-16(3)23(27(39)32-21(12-14-42-4)25(37)30-19(6-2)28(40)41)33-26(38)20(9-7-8-13-29)31-24(36)18-15-17(34)10-11-22(18)35/h10-11,15-16,19-21,23,34-35H,5-9,12-14,29H2,1-4H3,(H,30,37)(H,31,36)(H,32,39)(H,33,38)(H,40,41)/t16?,19?,20-,21-,23-/m0/s1
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n/an/a 4.60E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070751
PNG
(CHEMBL289734 | Nazumamide A (NAZA) analogue)
Show SMILES CCC(C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)NC(CC)C(O)=O
Show InChI InChI=1S/C28H45N5O8S/c1-5-16(3)23(27(39)30-19(6-2)28(40)41)33-26(38)21(12-14-42-4)32-25(37)20(9-7-8-13-29)31-24(36)18-15-17(34)10-11-22(18)35/h10-11,15-16,19-21,23,34-35H,5-9,12-14,29H2,1-4H3,(H,30,39)(H,31,36)(H,32,37)(H,33,38)(H,40,41)/t16?,19?,20-,21-,23-/m0/s1
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n/an/a 4.90E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070705
PNG
(CHEMBL2372759 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C34H49N5O8/c1-5-21(4)29(39-31(43)25(13-9-10-16-35)36-30(42)24-19-23(40)14-15-28(24)41)33(45)37-26(18-22-11-7-6-8-12-22)32(44)38-27(34(46)47)17-20(2)3/h6-8,11-12,14-15,19-21,25-27,29,40-41H,5,9-10,13,16-18,35H2,1-4H3,(H,36,42)(H,37,45)(H,38,44)(H,39,43)(H,46,47)/t21?,25-,26-,27-,29-/m0/s1
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n/an/a 5.10E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50215571
PNG
(Nazumamide A)
Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-c1cc(-[#8])ccc1-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6])-[#6](-[#8])=O
Show InChI InChI=1S/C28H43N7O8/c1-4-15(3)22(25(40)32-18(5-2)27(42)43)34-24(39)20-9-7-13-35(20)26(41)19(8-6-12-31-28(29)30)33-23(38)17-14-16(36)10-11-21(17)37/h10-11,14-15,18-20,22,36-37H,4-9,12-13H2,1-3H3,(H,32,40)(H,33,38)(H,34,39)(H,42,43)(H4,29,30,31)/t15-,18-,19-,20-,22-/m0/s1
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n/an/a 5.30E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070762
PNG
(CHEMBL2372731 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H43N5O10/c1-4-15(3)23(27(41)30-18(5-2)28(42)43)33-26(40)20(10-12-22(36)37)32-25(39)19(8-6-7-13-29)31-24(38)17-14-16(34)9-11-21(17)35/h9,11,14-15,18-20,23,34-35H,4-8,10,12-13,29H2,1-3H3,(H,30,41)(H,31,38)(H,32,39)(H,33,40)(H,36,37)(H,42,43)/t15?,18?,19-,20-,23-/m0/s1
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n/an/a 5.40E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070771
PNG
(CHEMBL2372696 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C(O)=O
Show InChI InChI=1S/C31H43N5O8/c1-4-18(2)26(30(42)35-24(16-20-10-6-5-7-11-20)29(41)33-19(3)31(43)44)36-28(40)23(12-8-9-15-32)34-27(39)22-17-21(37)13-14-25(22)38/h5-7,10-11,13-14,17-19,23-24,26,37-38H,4,8-9,12,15-16,32H2,1-3H3,(H,33,41)(H,34,39)(H,35,42)(H,36,40)(H,43,44)/t18?,19?,23-,24-,26-/m0/s1
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n/an/a 5.40E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070724
PNG
(CHEMBL2372703 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H47N5O8/c1-6-16(4)23(27(39)31-20(8-3)29(41)42)34-28(40)24(17(5)7-2)33-26(38)21(11-9-10-14-30)32-25(37)19-15-18(35)12-13-22(19)36/h12-13,15-17,20-21,23-24,35-36H,6-11,14,30H2,1-5H3,(H,31,39)(H,32,37)(H,33,38)(H,34,40)(H,41,42)/t16?,17?,20?,21-,23-,24-/m0/s1
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n/an/a 6.80E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070764
PNG
(CHEMBL2372664 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(O)=O)C(O)=O
Show InChI InChI=1S/C32H43N5O10/c1-3-18(2)27(37-29(43)22(11-7-8-14-33)34-28(42)21-16-20(38)12-13-25(21)39)31(45)35-23(15-19-9-5-4-6-10-19)30(44)36-24(32(46)47)17-26(40)41/h4-6,9-10,12-13,16,18,22-24,27,38-39H,3,7-8,11,14-15,17,33H2,1-2H3,(H,34,42)(H,35,45)(H,36,44)(H,37,43)(H,40,41)(H,46,47)/t18?,22-,23-,24-,27-/m0/s1
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n/an/a 6.90E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50215571
PNG
(Nazumamide A)
Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-c1cc(-[#8])ccc1-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6])-[#6](-[#8])=O
Show InChI InChI=1S/C28H43N7O8/c1-4-15(3)22(25(40)32-18(5-2)27(42)43)34-24(39)20-9-7-13-35(20)26(41)19(8-6-12-31-28(29)30)33-23(38)17-14-16(36)10-11-21(17)37/h10-11,14-15,18-20,22,36-37H,4-9,12-13H2,1-3H3,(H,32,40)(H,33,38)(H,34,39)(H,42,43)(H4,29,30,31)/t15-,18-,19-,20-,22-/m0/s1
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n/an/a 7.20E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50215571
PNG
(Nazumamide A)
Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-c1cc(-[#8])ccc1-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6])-[#6](-[#8])=O
Show InChI InChI=1S/C28H43N7O8/c1-4-15(3)22(25(40)32-18(5-2)27(42)43)34-24(39)20-9-7-13-35(20)26(41)19(8-6-12-31-28(29)30)33-23(38)17-14-16(36)10-11-21(17)37/h10-11,14-15,18-20,22,36-37H,4-9,12-13H2,1-3H3,(H,32,40)(H,33,38)(H,34,39)(H,42,43)(H4,29,30,31)/t15-,18-,19-,20-,22-/m0/s1
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n/an/a 7.20E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070734
PNG
(CHEMBL2372705 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H44N6O9/c1-4-15(3)23(27(41)31-18(5-2)28(42)43)34-26(40)20(10-12-22(30)37)33-25(39)19(8-6-7-13-29)32-24(38)17-14-16(35)9-11-21(17)36/h9,11,14-15,18-20,23,35-36H,4-8,10,12-13,29H2,1-3H3,(H2,30,37)(H,31,41)(H,32,38)(H,33,39)(H,34,40)(H,42,43)/t15?,18?,19-,20-,23-/m0/s1
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n/an/a 8.20E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070707
PNG
((S)-5-Guanidino-2-(toluene-4-sulfonylamino)-pentan...)
Show SMILES COC(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C14H22N4O4S/c1-10-5-7-11(8-6-10)23(20,21)18-12(13(19)22-2)4-3-9-17-14(15)16/h5-8,12,18H,3-4,9H2,1-2H3,(H4,15,16,17)/t12-/m0/s1
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n/an/a 8.90E+4n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070773
PNG
(CHEMBL2372738 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H41N5O9/c1-4-14(3)21(25(38)30-19(13-32)24(37)28-17(5-2)26(39)40)31-23(36)18(8-6-7-11-27)29-22(35)16-12-15(33)9-10-20(16)34/h9-10,12,14,17-19,21,32-34H,4-8,11,13,27H2,1-3H3,(H,28,37)(H,29,35)(H,30,38)(H,31,36)(H,39,40)/t14?,17?,18-,19-,21-/m0/s1
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n/an/a 1.06E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070745
PNG
(CHEMBL2372689 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H43N7O8/c1-4-16(3)24(28(42)33-20(5-2)29(43)44)36-27(41)22(12-17-14-31-15-32-17)35-26(40)21(8-6-7-11-30)34-25(39)19-13-18(37)9-10-23(19)38/h9-10,13-16,20-22,24,37-38H,4-8,11-12,30H2,1-3H3,(H,31,32)(H,33,42)(H,34,39)(H,35,40)(H,36,41)(H,43,44)/t16?,20?,21-,22-,24-/m0/s1
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n/an/a 1.09E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070741
PNG
(CHEMBL2372672 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H47N5O8/c1-6-17(5)24(28(40)31-20(7-2)29(41)42)34-27(39)22(14-16(3)4)33-26(38)21(10-8-9-13-30)32-25(37)19-15-18(35)11-12-23(19)36/h11-12,15-17,20-22,24,35-36H,6-10,13-14,30H2,1-5H3,(H,31,40)(H,32,37)(H,33,38)(H,34,39)(H,41,42)/t17?,20?,21-,22+,24-/m0/s1
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n/an/a 1.37E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070740
PNG
(CHEMBL2372701 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H43N5O8/c1-4-16(3)23(27(39)33-14-8-10-21(33)26(38)30-19(5-2)28(40)41)32-25(37)20(9-6-7-13-29)31-24(36)18-15-17(34)11-12-22(18)35/h11-12,15-16,19-21,23,34-35H,4-10,13-14,29H2,1-3H3,(H,30,38)(H,31,36)(H,32,37)(H,40,41)/t16?,19?,20-,21-,23-/m0/s1
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n/an/a 1.60E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070740
PNG
(CHEMBL2372701 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H43N5O8/c1-4-16(3)23(27(39)33-14-8-10-21(33)26(38)30-19(5-2)28(40)41)32-25(37)20(9-6-7-13-29)31-24(36)18-15-17(34)11-12-22(18)35/h11-12,15-16,19-21,23,34-35H,4-10,13-14,29H2,1-3H3,(H,30,38)(H,31,36)(H,32,37)(H,40,41)/t16?,19?,20-,21-,23-/m0/s1
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n/an/a 1.60E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070740
PNG
(CHEMBL2372701 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H43N5O8/c1-4-16(3)23(27(39)33-14-8-10-21(33)26(38)30-19(5-2)28(40)41)32-25(37)20(9-6-7-13-29)31-24(36)18-15-17(34)11-12-22(18)35/h11-12,15-16,19-21,23,34-35H,4-10,13-14,29H2,1-3H3,(H,30,38)(H,31,36)(H,32,37)(H,40,41)/t16?,19?,20-,21-,23-/m0/s1
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n/an/a 1.60E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070742
PNG
(CHEMBL2372740 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)NCCCCCC(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H47N5O8/c1-4-18(3)25(28(40)31-16-10-6-7-12-24(37)32-21(5-2)29(41)42)34-27(39)22(11-8-9-15-30)33-26(38)20-17-19(35)13-14-23(20)36/h13-14,17-18,21-22,25,35-36H,4-12,15-16,30H2,1-3H3,(H,31,40)(H,32,37)(H,33,38)(H,34,39)(H,41,42)/t18?,21?,22-,25-/m0/s1
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n/an/a 1.68E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070695
PNG
(CHEMBL2372716 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C34H46N6O8/c1-4-19(3)29(33(46)37-24(5-2)34(47)48)40-32(45)27(16-20-18-36-25-11-7-6-10-22(20)25)39-31(44)26(12-8-9-15-35)38-30(43)23-17-21(41)13-14-28(23)42/h6-7,10-11,13-14,17-19,24,26-27,29,36,41-42H,4-5,8-9,12,15-16,35H2,1-3H3,(H,37,46)(H,38,43)(H,39,44)(H,40,45)(H,47,48)/t19?,24?,26-,27-,29-/m0/s1
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n/an/a 1.69E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070716
PNG
(CHEMBL2372747 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H48N6O8/c1-4-17(3)24(28(41)32-20(5-2)29(42)43)35-27(40)22(11-7-9-15-31)34-26(39)21(10-6-8-14-30)33-25(38)19-16-18(36)12-13-23(19)37/h12-13,16-17,20-22,24,36-37H,4-11,14-15,30-31H2,1-3H3,(H,32,41)(H,33,38)(H,34,39)(H,35,40)(H,42,43)/t17?,20?,21-,22-,24-/m0/s1
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n/an/a 1.83E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070708
PNG
(CHEMBL2372743 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H41N5O8/c1-5-14(3)21(25(37)28-15(4)22(34)29-18(6-2)26(38)39)31-24(36)19(9-7-8-12-27)30-23(35)17-13-16(32)10-11-20(17)33/h10-11,13-15,18-19,21,32-33H,5-9,12,27H2,1-4H3,(H,28,37)(H,29,34)(H,30,35)(H,31,36)(H,38,39)/t14?,15-,18?,19-,21-/m0/s1
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n/an/a 1.94E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070766
PNG
(CHEMBL2372655 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C32H45N5O8/c1-4-19(3)27(31(43)36-25(17-20-11-7-6-8-12-20)30(42)34-23(5-2)32(44)45)37-29(41)24(13-9-10-16-33)35-28(40)22-18-21(38)14-15-26(22)39/h6-8,11-12,14-15,18-19,23-25,27,38-39H,4-5,9-10,13,16-17,33H2,1-3H3,(H,34,42)(H,35,40)(H,36,43)(H,37,41)(H,44,45)/t19?,23-,24-,25-,27-/m0/s1
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n/an/a 1.95E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070732
PNG
(CHEMBL2372662 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
Show InChI InChI=1S/C33H45N5O10/c1-3-19(2)28(38-30(44)23(11-7-8-16-34)35-29(43)22-18-21(39)12-14-26(22)40)32(46)37-25(17-20-9-5-4-6-10-20)31(45)36-24(33(47)48)13-15-27(41)42/h4-6,9-10,12,14,18-19,23-25,28,39-40H,3,7-8,11,13,15-17,34H2,1-2H3,(H,35,43)(H,36,45)(H,37,46)(H,38,44)(H,41,42)(H,47,48)/t19?,23-,24-,25-,28-/m0/s1
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n/an/a 2.00E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070714
PNG
(CHEMBL2372741 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)NCCCC(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H43N5O8/c1-4-16(3)23(26(38)29-14-8-10-22(35)30-19(5-2)27(39)40)32-25(37)20(9-6-7-13-28)31-24(36)18-15-17(33)11-12-21(18)34/h11-12,15-16,19-20,23,33-34H,4-10,13-14,28H2,1-3H3,(H,29,38)(H,30,35)(H,31,36)(H,32,37)(H,39,40)/t16?,19?,20-,23-/m0/s1
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n/an/a 2.62E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50215734
PNG
(CHEMBL2372700)
Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-c1cc(-[#8])ccc1-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6])-[#6](-[#8])=O
Show InChI InChI=1S/C29H48N8O8/c1-4-16(3)23(27(43)34-19(5-2)28(44)45)37-26(42)21(10-8-14-33-29(31)32)36-25(41)20(9-6-7-13-30)35-24(40)18-15-17(38)11-12-22(18)39/h11-12,15-16,19-21,23,38-39H,4-10,13-14,30H2,1-3H3,(H,34,43)(H,35,40)(H,36,41)(H,37,42)(H,44,45)(H4,31,32,33)/t16-,19-,20-,21-,23-/m0/s1
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n/an/a 2.73E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070715
PNG
(CHEMBL2372742 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H47N5O8/c1-6-16(4)23(27(39)31-20(8-3)29(41)42)34-28(40)24(17(5)7-2)33-26(38)21(11-9-10-14-30)32-25(37)19-15-18(35)12-13-22(19)36/h12-13,15-17,20-21,23-24,35-36H,6-11,14,30H2,1-5H3,(H,31,39)(H,32,37)(H,33,38)(H,34,40)(H,41,42)/t16-,17-,20?,21-,23-,24-/m0/s1
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n/an/a 2.94E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070721
PNG
(CHEMBL2372692 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CC(O)CN1C(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H43N5O9/c1-4-15(3)23(26(39)30-19(5-2)28(41)42)32-25(38)21-13-17(35)14-33(21)27(40)20(8-6-7-11-29)31-24(37)18-12-16(34)9-10-22(18)36/h9-10,12,15,17,19-21,23,34-36H,4-8,11,13-14,29H2,1-3H3,(H,30,39)(H,31,37)(H,32,38)(H,41,42)/t15?,17?,19?,20-,21-,23-/m0/s1
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n/an/a 2.98E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070772
PNG
(CHEMBL2372675 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H44N6O9/c1-4-15(3)23(27(41)33-20(10-12-22(30)37)25(39)31-18(5-2)28(42)43)34-26(40)19(8-6-7-13-29)32-24(38)17-14-16(35)9-11-21(17)36/h9,11,14-15,18-20,23,35-36H,4-8,10,12-13,29H2,1-3H3,(H2,30,37)(H,31,39)(H,32,38)(H,33,41)(H,34,40)(H,42,43)/t15?,18?,19-,20-,23-/m0/s1
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n/an/a 3.00E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070716
PNG
(CHEMBL2372747 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H48N6O8/c1-4-17(3)24(28(41)32-20(5-2)29(42)43)35-27(40)22(11-7-9-15-31)34-26(39)21(10-6-8-14-30)33-25(38)19-16-18(36)12-13-23(19)37/h12-13,16-17,20-22,24,36-37H,4-11,14-15,30-31H2,1-3H3,(H,32,41)(H,33,38)(H,34,39)(H,35,40)(H,42,43)/t17?,20?,21-,22-,24-/m0/s1
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n/an/a 3.08E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070716
PNG
(CHEMBL2372747 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H48N6O8/c1-4-17(3)24(28(41)32-20(5-2)29(42)43)35-27(40)22(11-7-9-15-31)34-26(39)21(10-6-8-14-30)33-25(38)19-16-18(36)12-13-23(19)37/h12-13,16-17,20-22,24,36-37H,4-11,14-15,30-31H2,1-3H3,(H,32,41)(H,33,38)(H,34,39)(H,35,40)(H,42,43)/t17?,20?,21-,22-,24-/m0/s1
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n/an/a 3.08E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070775
PNG
(CHEMBL2372693 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(C)C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H41N5O8/c1-5-14(3)21(25(37)29-18(6-2)26(38)39)31-22(34)15(4)28-24(36)19(9-7-8-12-27)30-23(35)17-13-16(32)10-11-20(17)33/h10-11,13-15,18-19,21,32-33H,5-9,12,27H2,1-4H3,(H,28,36)(H,29,37)(H,30,35)(H,31,34)(H,38,39)/t14?,15-,18?,19-,21-/m0/s1
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n/an/a 3.18E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070736
PNG
(CHEMBL2372745 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H42N6O9/c1-4-14(3)22(26(40)32-19(13-21(29)36)25(39)30-17(5-2)27(41)42)33-24(38)18(8-6-7-11-28)31-23(37)16-12-15(34)9-10-20(16)35/h9-10,12,14,17-19,22,34-35H,4-8,11,13,28H2,1-3H3,(H2,29,36)(H,30,39)(H,31,37)(H,32,40)(H,33,38)(H,41,42)/t14?,17?,18-,19-,22-/m0/s1
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n/an/a 3.41E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070682
PNG
(CHEMBL2372691 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CSCN1C(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H41N5O8S/c1-4-15(3)22(25(37)29-18(5-2)27(39)40)31-24(36)20-13-41-14-32(20)26(38)19(8-6-7-11-28)30-23(35)17-12-16(33)9-10-21(17)34/h9-10,12,15,18-20,22,33-34H,4-8,11,13-14,28H2,1-3H3,(H,29,37)(H,30,35)(H,31,36)(H,39,40)/t15?,18?,19-,20-,22-/m0/s1
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n/an/a 3.78E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070727
PNG
(CHEMBL2372734 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H43N5O9/c1-5-14(3)21(25(38)32-22(15(4)33)26(39)29-18(6-2)27(40)41)31-24(37)19(9-7-8-12-28)30-23(36)17-13-16(34)10-11-20(17)35/h10-11,13-15,18-19,21-22,33-35H,5-9,12,28H2,1-4H3,(H,29,39)(H,30,36)(H,31,37)(H,32,38)(H,40,41)/t14?,15?,18?,19-,21-,22-/m0/s1
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n/an/a 3.94E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070763
PNG
(CHEMBL2372750 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)NCCC(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H41N5O8/c1-4-15(3)22(25(37)28-13-11-21(34)29-18(5-2)26(38)39)31-24(36)19(8-6-7-12-27)30-23(35)17-14-16(32)9-10-20(17)33/h9-10,14-15,18-19,22,32-33H,4-8,11-13,27H2,1-3H3,(H,28,37)(H,29,34)(H,30,35)(H,31,36)(H,38,39)/t15?,18?,19-,22-/m0/s1
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n/an/a 4.06E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070731
PNG
(CHEMBL2372714 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H43N7O8/c1-4-16(3)24(28(42)35-22(12-17-14-31-15-32-17)27(41)33-20(5-2)29(43)44)36-26(40)21(8-6-7-11-30)34-25(39)19-13-18(37)9-10-23(19)38/h9-10,13-16,20-22,24,37-38H,4-8,11-12,30H2,1-3H3,(H,31,32)(H,33,41)(H,34,39)(H,35,42)(H,36,40)(H,43,44)/t16?,20?,21-,22-,24-/m0/s1
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n/an/a 4.22E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070743
PNG
(CHEMBL2372730 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H41N5O8/c1-5-14(3)21(25(37)28-15(4)22(34)29-18(6-2)26(38)39)31-24(36)19(9-7-8-12-27)30-23(35)17-13-16(32)10-11-20(17)33/h10-11,13-15,18-19,21,32-33H,5-9,12,27H2,1-4H3,(H,28,37)(H,29,34)(H,30,35)(H,31,36)(H,38,39)/t14?,15-,18?,19+,21+/m1/s1
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n/an/a 4.28E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070755
PNG
(CHEMBL2372690 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)NCC(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C25H39N5O8/c1-4-14(3)21(24(36)27-13-20(33)28-17(5-2)25(37)38)30-23(35)18(8-6-7-11-26)29-22(34)16-12-15(31)9-10-19(16)32/h9-10,12,14,17-18,21,31-32H,4-8,11,13,26H2,1-3H3,(H,27,36)(H,28,33)(H,29,34)(H,30,35)(H,37,38)/t14?,17?,18-,21-/m0/s1
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n/an/a 4.46E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070706
PNG
(CHEMBL2372653 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H41N5O9/c1-4-14(3)21(25(38)28-17(5-2)26(39)40)31-24(37)19(13-32)30-23(36)18(8-6-7-11-27)29-22(35)16-12-15(33)9-10-20(16)34/h9-10,12,14,17-19,21,32-34H,4-8,11,13,27H2,1-3H3,(H,28,38)(H,29,35)(H,30,36)(H,31,37)(H,39,40)/t14?,17?,18-,19-,21-/m0/s1
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n/an/a 4.46E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070720
PNG
(CHEMBL2372704 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H43N5O10/c1-4-15(3)23(27(41)32-20(10-12-22(36)37)25(39)30-18(5-2)28(42)43)33-26(40)19(8-6-7-13-29)31-24(38)17-14-16(34)9-11-21(17)35/h9,11,14-15,18-20,23,34-35H,4-8,10,12-13,29H2,1-3H3,(H,30,39)(H,31,38)(H,32,41)(H,33,40)(H,36,37)(H,42,43)/t15?,18?,19-,20-,23-/m0/s1
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n/an/a 4.58E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070746
PNG
(CHEMBL2372679 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H47N5O8/c1-6-17(5)24(28(40)33-22(14-16(3)4)27(39)31-20(7-2)29(41)42)34-26(38)21(10-8-9-13-30)32-25(37)19-15-18(35)11-12-23(19)36/h11-12,15-17,20-22,24,35-36H,6-10,13-14,30H2,1-5H3,(H,31,39)(H,32,37)(H,33,40)(H,34,38)(H,41,42)/t17?,20?,21-,22-,24-/m0/s1
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n/an/a 5.07E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070722
PNG
(CHEMBL2372752 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H47N5O8/c1-6-17(5)24(28(40)31-20(7-2)29(41)42)34-27(39)22(14-16(3)4)33-26(38)21(10-8-9-13-30)32-25(37)19-15-18(35)11-12-23(19)36/h11-12,15-17,20-22,24,35-36H,6-10,13-14,30H2,1-5H3,(H,31,40)(H,32,37)(H,33,38)(H,34,39)(H,41,42)/t17?,20?,21-,22-,24-/m0/s1
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n/an/a 5.07E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070778
PNG
(CHEMBL2372671 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)[C@@H](C)O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H43N5O9/c1-5-14(3)21(25(38)29-18(6-2)27(40)41)31-26(39)22(15(4)33)32-24(37)19(9-7-8-12-28)30-23(36)17-13-16(34)10-11-20(17)35/h10-11,13-15,18-19,21-22,33-35H,5-9,12,28H2,1-4H3,(H,29,38)(H,30,36)(H,31,39)(H,32,37)(H,40,41)/t14?,15-,18?,19+,21+,22+/m1/s1
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n/an/a 5.46E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070740
PNG
(CHEMBL2372701 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H43N5O8/c1-4-16(3)23(27(39)33-14-8-10-21(33)26(38)30-19(5-2)28(40)41)32-25(37)20(9-6-7-13-29)31-24(36)18-15-17(34)11-12-22(18)35/h11-12,15-16,19-21,23,34-35H,4-10,13-14,29H2,1-3H3,(H,30,38)(H,31,36)(H,32,37)(H,40,41)/t16?,19?,20-,21-,23-/m0/s1
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n/an/a 5.82E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070739
PNG
(CHEMBL2372753 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@H](C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C29H48N6O8/c1-4-17(3)24(28(41)34-21(10-6-8-14-30)26(39)32-20(5-2)29(42)43)35-27(40)22(11-7-9-15-31)33-25(38)19-16-18(36)12-13-23(19)37/h12-13,16-17,20-22,24,36-37H,4-11,14-15,30-31H2,1-3H3,(H,32,39)(H,33,38)(H,34,41)(H,35,40)(H,42,43)/t17?,20?,21-,22-,24-/m0/s1
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n/an/a 5.93E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070694
PNG
(CHEMBL2372715 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C32H45N5O9/c1-4-18(3)27(31(44)34-23(5-2)32(45)46)37-30(43)25(16-19-9-11-20(38)12-10-19)36-29(42)24(8-6-7-15-33)35-28(41)22-17-21(39)13-14-26(22)40/h9-14,17-18,23-25,27,38-40H,4-8,15-16,33H2,1-3H3,(H,34,44)(H,35,41)(H,36,42)(H,37,43)(H,45,46)/t18?,23?,24-,25-,27-/m0/s1
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n/an/a 6.72E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070733
PNG
(CHEMBL2372744 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H41N5O10/c1-4-14(3)22(26(40)31-19(13-21(35)36)25(39)29-17(5-2)27(41)42)32-24(38)18(8-6-7-11-28)30-23(37)16-12-15(33)9-10-20(16)34/h9-10,12,14,17-19,22,33-34H,4-8,11,13,28H2,1-3H3,(H,29,39)(H,30,37)(H,31,40)(H,32,38)(H,35,36)(H,41,42)/t14?,17?,18-,19-,22-/m0/s1
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n/an/a 6.80E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070749
PNG
(CHEMBL2372677 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H42N6O9/c1-4-14(3)22(26(40)30-17(5-2)27(41)42)33-25(39)19(13-21(29)36)32-24(38)18(8-6-7-11-28)31-23(37)16-12-15(34)9-10-20(16)35/h9-10,12,14,17-19,22,34-35H,4-8,11,13,28H2,1-3H3,(H2,29,36)(H,30,40)(H,31,37)(H,32,38)(H,33,39)(H,41,42)/t14?,17?,18-,19-,22-/m0/s1
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n/an/a 7.11E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070752
PNG
(CHEMBL2372694 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H43N5O8/c1-5-15(4)22(26(38)29-18(6-2)24(36)30-19(7-3)27(39)40)32-25(37)20(10-8-9-13-28)31-23(35)17-14-16(33)11-12-21(17)34/h11-12,14-15,18-20,22,33-34H,5-10,13,28H2,1-4H3,(H,29,38)(H,30,36)(H,31,35)(H,32,37)(H,39,40)/t15?,18?,19?,20-,22-/m0/s1
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n/an/a 7.48E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070754
PNG
(CHEMBL2372669 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)CCNC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H41N5O8/c1-4-15(3)22(25(37)29-18(5-2)26(38)39)31-21(34)11-13-28-24(36)19(8-6-7-12-27)30-23(35)17-14-16(32)9-10-20(17)33/h9-10,14-15,18-19,22,32-33H,4-8,11-13,27H2,1-3H3,(H,28,36)(H,29,37)(H,30,35)(H,31,34)(H,38,39)/t15?,18?,19-,22-/m0/s1
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n/an/a 8.21E+5n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070756
PNG
(CHEMBL2372676 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H41N5O10/c1-4-14(3)22(26(40)29-17(5-2)27(41)42)32-25(39)19(13-21(35)36)31-24(38)18(8-6-7-11-28)30-23(37)16-12-15(33)9-10-20(16)34/h9-10,12,14,17-19,22,33-34H,4-8,11,13,28H2,1-3H3,(H,29,40)(H,30,37)(H,31,38)(H,32,39)(H,35,36)(H,41,42)/t14?,17?,18-,19-,22-/m0/s1
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n/an/a 1.26E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070701
PNG
(CHEMBL2372661 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C33H41N5O8/c1-4-18(3)28(31(43)35-23(5-2)33(45)46)37-30(42)26-11-8-14-38(26)32(44)25(15-19-17-34-24-10-7-6-9-21(19)24)36-29(41)22-16-20(39)12-13-27(22)40/h6-7,9-10,12-13,16-18,23,25-26,28,34,39-40H,4-5,8,11,14-15H2,1-3H3,(H,35,43)(H,36,41)(H,37,42)(H,45,46)/t18?,23?,25-,26-,28-/m0/s1
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n/an/a 1.71E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070723
PNG
(CHEMBL2372719 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C25H36N4O8/c1-5-13(3)20(23(34)27-17(6-2)25(36)37)28-22(33)18-8-7-11-29(18)24(35)14(4)26-21(32)16-12-15(30)9-10-19(16)31/h9-10,12-14,17-18,20,30-31H,5-8,11H2,1-4H3,(H,26,32)(H,27,34)(H,28,33)(H,36,37)/t13?,14-,17?,18+,20+/m1/s1
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n/an/a 1.75E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070693
PNG
(CHEMBL2372707 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H42N4O8/c1-6-16(5)23(26(37)29-19(7-2)28(39)40)31-25(36)21-9-8-12-32(21)27(38)20(13-15(3)4)30-24(35)18-14-17(33)10-11-22(18)34/h10-11,14-16,19-21,23,33-34H,6-9,12-13H2,1-5H3,(H,29,37)(H,30,35)(H,31,36)(H,39,40)/t16?,19?,20-,21+,23+/m1/s1
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n/an/a 1.89E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070779
PNG
(CHEMBL2372682 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CCCCCNC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H42N4O8/c1-4-17(3)24(27(38)30-20(5-2)28(39)40)31-26(37)21-10-9-15-32(21)23(35)11-7-6-8-14-29-25(36)19-16-18(33)12-13-22(19)34/h12-13,16-17,20-21,24,33-34H,4-11,14-15H2,1-3H3,(H,29,36)(H,30,38)(H,31,37)(H,39,40)/t17?,20?,21-,24-/m0/s1
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n/an/a 2.16E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070686
PNG
(CHEMBL2372651 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C31H40N4O8/c1-4-18(3)26(29(40)32-22(5-2)31(42)43)34-28(39)24-12-9-15-35(24)30(41)23(16-19-10-7-6-8-11-19)33-27(38)21-17-20(36)13-14-25(21)37/h6-8,10-11,13-14,17-18,22-24,26,36-37H,4-5,9,12,15-16H2,1-3H3,(H,32,40)(H,33,38)(H,34,39)(H,42,43)/t18?,22?,23-,24-,26-/m0/s1
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n/an/a 2.21E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070711
PNG
(CHEMBL2372729 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C25H36N4O9/c1-4-13(3)20(23(35)26-16(5-2)25(37)38)28-22(34)18-7-6-10-29(18)24(36)17(12-30)27-21(33)15-11-14(31)8-9-19(15)32/h8-9,11,13,16-18,20,30-32H,4-7,10,12H2,1-3H3,(H,26,35)(H,27,33)(H,28,34)(H,37,38)/t13?,16?,17-,18-,20-/m0/s1
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n/an/a 2.33E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070760
PNG
(CHEMBL2372660 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C31H40N4O9/c1-4-17(3)26(29(41)32-22(5-2)31(43)44)34-28(40)24-7-6-14-35(24)30(42)23(15-18-8-10-19(36)11-9-18)33-27(39)21-16-20(37)12-13-25(21)38/h8-13,16-17,22-24,26,36-38H,4-7,14-15H2,1-3H3,(H,32,41)(H,33,39)(H,34,40)(H,43,44)/t17?,22?,23-,24-,26-/m0/s1
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n/an/a 2.43E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070737
PNG
(CHEMBL2372754 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(O)=O)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H36N4O10/c1-4-13(3)21(24(37)27-16(5-2)26(39)40)29-23(36)18-7-6-10-30(18)25(38)17(12-20(33)34)28-22(35)15-11-14(31)8-9-19(15)32/h8-9,11,13,16-18,21,31-32H,4-7,10,12H2,1-3H3,(H,27,37)(H,28,35)(H,29,36)(H,33,34)(H,39,40)/t13?,16?,17-,18-,21-/m0/s1
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n/an/a 2.46E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070702
PNG
(CHEMBL2372718 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H39N5O9/c1-4-14(3)22(25(38)29-17(5-2)27(40)41)31-24(37)19-7-6-12-32(19)26(39)18(9-11-21(28)35)30-23(36)16-13-15(33)8-10-20(16)34/h8,10,13-14,17-19,22,33-34H,4-7,9,11-12H2,1-3H3,(H2,28,35)(H,29,38)(H,30,36)(H,31,37)(H,40,41)/t14?,17?,18-,19-,22-/m0/s1
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n/an/a 2.55E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070728
PNG
(CHEMBL2372659 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)c1cc(O)ccc1O)C(C)C)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H40N4O8/c1-6-15(5)22(25(36)28-18(7-2)27(38)39)30-24(35)19-9-8-12-31(19)26(37)21(14(3)4)29-23(34)17-13-16(32)10-11-20(17)33/h10-11,13-15,18-19,21-22,32-33H,6-9,12H2,1-5H3,(H,28,36)(H,29,34)(H,30,35)(H,38,39)/t15?,18?,19-,21-,22-/m0/s1
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n/an/a 2.58E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070689
PNG
(CHEMBL2372706 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H40N4O8S/c1-5-15(3)22(25(36)28-18(6-2)27(38)39)30-24(35)20-8-7-12-31(20)26(37)19(11-13-40-4)29-23(34)17-14-16(32)9-10-21(17)33/h9-10,14-15,18-20,22,32-33H,5-8,11-13H2,1-4H3,(H,28,36)(H,29,34)(H,30,35)(H,38,39)/t15?,18?,19-,20-,22-/m0/s1
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n/an/a 2.63E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070697
PNG
(CHEMBL2372708 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)c1cc(O)ccc1O)[C@@H](C)CC)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H42N4O8/c1-6-15(4)22(26(37)29-19(8-3)28(39)40)30-25(36)20-10-9-13-32(20)27(38)23(16(5)7-2)31-24(35)18-14-17(33)11-12-21(18)34/h11-12,14-16,19-20,22-23,33-34H,6-10,13H2,1-5H3,(H,29,37)(H,30,36)(H,31,35)(H,39,40)/t15?,16-,19?,20-,22-,23-/m0/s1
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n/an/a 2.71E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070698
PNG
(CHEMBL2372670 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](CC(C)C)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H42N4O8/c1-6-16(5)23(26(37)29-19(7-2)28(39)40)31-25(36)21-9-8-12-32(21)27(38)20(13-15(3)4)30-24(35)18-14-17(33)10-11-22(18)34/h10-11,14-16,19-21,23,33-34H,6-9,12-13H2,1-5H3,(H,29,37)(H,30,35)(H,31,36)(H,39,40)/t16?,19?,20-,21-,23-/m0/s1
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n/an/a 2.78E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070712
PNG
(CHEMBL2372748 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C28H38N6O8/c1-4-15(3)23(26(39)31-19(5-2)28(41)42)33-25(38)21-7-6-10-34(21)27(40)20(11-16-13-29-14-30-16)32-24(37)18-12-17(35)8-9-22(18)36/h8-9,12-15,19-21,23,35-36H,4-7,10-11H2,1-3H3,(H,29,30)(H,31,39)(H,32,37)(H,33,38)(H,41,42)/t15?,19?,20-,21-,23-/m0/s1
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n/an/a 2.80E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070688
PNG
(CHEMBL2372658 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H38N4O8/c1-5-14(4)21(24(35)28-18(7-3)26(37)38)29-23(34)19-9-8-12-30(19)25(36)17(6-2)27-22(33)16-13-15(31)10-11-20(16)32/h10-11,13-14,17-19,21,31-32H,5-9,12H2,1-4H3,(H,27,33)(H,28,35)(H,29,34)(H,37,38)/t14?,17?,18?,19-,21-/m0/s1
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n/an/a 2.87E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070748
PNG
(CHEMBL2372681 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](C)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C25H36N4O8/c1-5-13(3)20(23(34)27-17(6-2)25(36)37)28-22(33)18-8-7-11-29(18)24(35)14(4)26-21(32)16-12-15(30)9-10-19(16)31/h9-10,12-14,17-18,20,30-31H,5-8,11H2,1-4H3,(H,26,32)(H,27,34)(H,28,33)(H,36,37)/t13?,14-,17?,18-,20-/m0/s1
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n/an/a 2.96E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070750
PNG
(CHEMBL2372749 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C24H34N4O8/c1-4-13(3)20(23(34)26-16(5-2)24(35)36)27-22(33)17-7-6-10-28(17)19(31)12-25-21(32)15-11-14(29)8-9-18(15)30/h8-9,11,13,16-17,20,29-30H,4-7,10,12H2,1-3H3,(H,25,32)(H,26,34)(H,27,33)(H,35,36)/t13?,16?,17-,20-/m0/s1
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n/an/a 2.99E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070769
PNG
(CHEMBL2372683 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CCCNC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H38N4O8/c1-4-15(3)22(25(36)28-18(5-2)26(37)38)29-24(35)19-8-7-13-30(19)21(33)9-6-12-27-23(34)17-14-16(31)10-11-20(17)32/h10-11,14-15,18-19,22,31-32H,4-9,12-13H2,1-3H3,(H,27,34)(H,28,36)(H,29,35)(H,37,38)/t15?,18?,19-,22-/m0/s1
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n/an/a 3.01E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070683
PNG
(CHEMBL2372728 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)c1cc(O)ccc1O)[C@@H](C)O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H38N4O9/c1-5-13(3)20(24(36)27-17(6-2)26(38)39)28-23(35)18-8-7-11-30(18)25(37)21(14(4)31)29-22(34)16-12-15(32)9-10-19(16)33/h9-10,12-14,17-18,20-21,31-33H,5-8,11H2,1-4H3,(H,27,36)(H,28,35)(H,29,34)(H,38,39)/t13?,14?,17?,18-,20-,21-/m0/s1
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n/an/a 3.15E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070696
PNG
(CHEMBL2372755 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(O)=O)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H38N4O10/c1-4-14(3)22(25(38)28-17(5-2)27(40)41)30-24(37)19-7-6-12-31(19)26(39)18(9-11-21(34)35)29-23(36)16-13-15(32)8-10-20(16)33/h8,10,13-14,17-19,22,32-33H,4-7,9,11-12H2,1-3H3,(H,28,38)(H,29,36)(H,30,37)(H,34,35)(H,40,41)/t14?,17?,18-,19-,22-/m0/s1
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n/an/a 3.33E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070759
PNG
(CHEMBL2372717 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C27H38N4O8/c1-4-15(3)22(24(35)28-18(5-2)27(38)39)29-23(34)19-8-6-12-30(19)26(37)20-9-7-13-31(20)25(36)17-14-16(32)10-11-21(17)33/h10-11,14-15,18-20,22,32-33H,4-9,12-13H2,1-3H3,(H,28,35)(H,29,34)(H,38,39)/t15?,18?,19-,20-,22-/m0/s1
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n/an/a 3.38E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070710
PNG
(CHEMBL2372756 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C26H37N5O9/c1-4-13(3)21(24(37)28-16(5-2)26(39)40)30-23(36)18-7-6-10-31(18)25(38)17(12-20(27)34)29-22(35)15-11-14(32)8-9-19(15)33/h8-9,11,13,16-18,21,32-33H,4-7,10,12H2,1-3H3,(H2,27,34)(H,28,37)(H,29,35)(H,30,36)(H,39,40)/t13?,16?,17-,18-,21-/m0/s1
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n/an/a 3.39E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50070719
PNG
(CHEMBL2372680 | Nazumamide A (NAZA) analogue)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CCNC(=O)c1cc(O)ccc1O)C(=O)N[C@@H](CC)C(O)=O
Show InChI InChI=1S/C25H36N4O8/c1-4-14(3)21(24(35)27-17(5-2)25(36)37)28-23(34)18-7-6-12-29(18)20(32)10-11-26-22(33)16-13-15(30)8-9-19(16)31/h8-9,13-14,17-18,21,30-31H,4-7,10-12H2,1-3H3,(H,26,33)(H,27,35)(H,28,34)(H,36,37)/t14?,17?,18-,21-/m0/s1
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n/an/a 3.54E+6n/an/an/an/a8.3n/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3.

Bioorg Med Chem Lett 8: 1669-72 (1999)


BindingDB Entry DOI: 10.7270/Q2G73CV8
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%