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Compile Data Set for Download or QSAR

Found 68 hits with Last Name = 'gladysz' and Initial = 'r'   
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
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM16152
PNG
(2-({4-chloro-1-[(diaminomethylidene)amino]isoquino...)
Show SMILES [#6]C([#6])([#7]S(=O)(=O)c1ccc2c(Cl)cnc(\[#7]=[#6](/[#7])-[#7])c2c1)[#6](-[#8])=O
Show InChI InChI=1S/C14H16ClN5O4S/c1-14(2,12(21)22)20-25(23,24)7-3-4-8-9(5-7)11(19-13(16)17)18-6-10(8)15/h3-6,20H,1-2H3,(H,21,22)(H4,16,17,18,19)
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 10n/an/an/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using S-2444 as substrate

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50231520
PNG
((R)-N-[(S)-1-(4-carbamimidoyl-benzylcarbamoyl)-2-h...)
Show SMILES NC(=N)c1ccc(CNC(=O)[C@H](CO)NC(=O)[C@@H](CO)NS(=O)(=O)Cc2ccccc2)cc1
Show InChI InChI=1S/C21H27N5O6S/c22-19(23)16-8-6-14(7-9-16)10-24-20(29)17(11-27)25-21(30)18(12-28)26-33(31,32)13-15-4-2-1-3-5-15/h1-9,17-18,26-28H,10-13H2,(H3,22,23)(H,24,29)(H,25,30)/t17-,18+/m0/s1
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 20n/an/an/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50147422
PNG
(3-(4-Chloro-1-guanidino-isoquinolin-7-yl)-benzoic ...)
Show SMILES [#7]\[#6](-[#7])=[#7]\c1ncc(Cl)c2ccc(cc12)-c1cccc(c1)-[#6](-[#8])=O
Show InChI InChI=1S/C17H13ClN4O2/c18-14-8-21-15(22-17(19)20)13-7-10(4-5-12(13)14)9-2-1-3-11(6-9)16(23)24/h1-8H,(H,23,24)(H4,19,20,21,22)
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 37n/an/an/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using S-2444 as substrate

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM23891
PNG
(3-amidinophenylalanine deriv., 35 | CHEMBL107955 |...)
Show SMILES CCOC(=O)N1CCN(CC1)C(=O)[C@H](Cc1cccc(c1)C(N)=N)NS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C |r|
Show InChI InChI=1S/C32H47N5O5S/c1-8-42-32(39)37-14-12-36(13-15-37)31(38)28(17-23-10-9-11-24(16-23)30(33)34)35-43(40,41)29-26(21(4)5)18-25(20(2)3)19-27(29)22(6)7/h9-11,16,18-22,28,35H,8,12-15,17H2,1-7H3,(H3,33,34)/t28-/m0/s1
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 410n/an/an/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of uPA (unknown origin)

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499900
PNG
(CHEMBL3740183)
Show SMILES CCCCNC(=O)c1ccn2c(NCc3ccc(NC(N)=N)cc3)cnc2c1
Show InChI InChI=1S/C20H25N7O/c1-2-3-9-23-19(28)15-8-10-27-17(11-15)25-13-18(27)24-12-14-4-6-16(7-5-14)26-20(21)22/h4-8,10-11,13,24H,2-3,9,12H2,1H3,(H,23,28)(H4,21,22,26)
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n/an/a 97n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499914
PNG
(CHEMBL3740973)
Show SMILES NC(=N)Nc1ccc(CNc2cnc3cc(ccn23)C(=O)NC2CCCC2)cc1
Show InChI InChI=1S/C21H25N7O/c22-21(23)27-17-7-5-14(6-8-17)12-24-19-13-25-18-11-15(9-10-28(18)19)20(29)26-16-3-1-2-4-16/h5-11,13,16,24H,1-4,12H2,(H,26,29)(H4,22,23,27)
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n/an/a 174n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499920
PNG
(CHEMBL3741622)
Show SMILES NC(=N)Nc1ccc(CNc2cnc3cc(ccn23)C(=O)NC2CC2)cc1
Show InChI InChI=1S/C19H21N7O/c20-19(21)25-15-3-1-12(2-4-15)10-22-17-11-23-16-9-13(7-8-26(16)17)18(27)24-14-5-6-14/h1-4,7-9,11,14,22H,5-6,10H2,(H,24,27)(H4,20,21,25)
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n/an/a 184n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499913
PNG
(CHEMBL3741173)
Show SMILES NC(=N)Nc1ccc(CNc2cnc3cc(ccn23)C(=O)NCc2cccc(F)c2)cc1
Show InChI InChI=1S/C23H22FN7O/c24-18-3-1-2-16(10-18)13-29-22(32)17-8-9-31-20(11-17)28-14-21(31)27-12-15-4-6-19(7-5-15)30-23(25)26/h1-11,14,27H,12-13H2,(H,29,32)(H4,25,26,30)
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n/an/a 254n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Cysteine protease ATG4B


(Homo sapiens (Human))		BDBM80861
PNG
(4-[2-(2-Cyclohexyl-5,6-dimethyl-thieno[2,3-d]pyrim...)
Show SMILES Cc1sc2nc(nc(SCC(=O)N3CC(=O)Nc4ccccc34)c2c1C)C1CCCCC1
Show InChI InChI=1S/C24H26N4O2S2/c1-14-15(2)32-24-21(14)23(26-22(27-24)16-8-4-3-5-9-16)31-13-20(30)28-12-19(29)25-17-10-6-7-11-18(17)28/h6-7,10-11,16H,3-5,8-9,12-13H2,1-2H3,(H,25,29)
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n/an/a 316n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of wild type recombinant Atg4B (unknown origin) expressed in Escherichia coli BL21 DE3 using N-terminal His6-tagged LC3B-PLA2 as substrate...

Eur J Med Chem 123: 631-638 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.073
BindingDB Entry DOI: 10.7270/Q2FT8P1P
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))		BDBM50363655
PNG
(CHEMBL1945236)
Show SMILES NC(=N)c1ccc(\C=C2\N=C(OC2=O)c2ccccc2)cc1 |c:9|
Show InChI InChI=1S/C17H13N3O2/c18-15(19)12-8-6-11(7-9-12)10-14-17(21)22-16(20-14)13-4-2-1-3-5-13/h1-10H,(H3,18,19)/b14-10+
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n/an/a 340n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human plasma plasmin using pyroGlu-Pro-Arg-pNA-HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499919
PNG
(CHEMBL3740904)
Show SMILES NC(=N)Nc1ccc(CNc2cnc3cc(ccn23)C(=O)NCCO)cc1
Show InChI InChI=1S/C18H21N7O2/c19-18(20)24-14-3-1-12(2-4-14)10-22-16-11-23-15-9-13(5-7-25(15)16)17(27)21-6-8-26/h1-5,7,9,11,22,26H,6,8,10H2,(H,21,27)(H4,19,20,24)
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n/an/a 366n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499916
PNG
(CHEMBL3741100)
Show SMILES CN1CCN(CCNC(=O)c2ccn3c(NCc4ccc(NC(N)=N)cc4)cnc3c2)CC1
Show InChI InChI=1S/C23H31N9O/c1-30-10-12-31(13-11-30)9-7-26-22(33)18-6-8-32-20(14-18)28-16-21(32)27-15-17-2-4-19(5-3-17)29-23(24)25/h2-6,8,14,16,27H,7,9-13,15H2,1H3,(H,26,33)(H4,24,25,29)
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n/an/a 404n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50104435
PNG
(4-(6-Guanidino-hexanoyloxy)-benzoic acid ethyl est...)
Show SMILES CCOC(=O)c1ccc(OC(=O)CCCCCNC(N)=N)cc1
Show InChI InChI=1S/C16H23N3O4/c1-2-22-15(21)12-7-9-13(10-8-12)23-14(20)6-4-3-5-11-19-16(17)18/h7-10H,2-6,11H2,1H3,(H4,17,18,19)
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n/an/a 431n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Cysteine protease ATG4B


(Homo sapiens (Human))		BDBM50085339
PNG
(((S)-1-Benzyl-3-chloro-2-oxo-propyl)-carbamic acid...)
Show SMILES ClCC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C18H18ClNO3/c19-12-17(21)16(11-14-7-3-1-4-8-14)20-18(22)23-13-15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,20,22)/t16-/m0/s1
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n/an/a 630n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of Atg4B (unknown origin) using YFP-LC3B-EmGFP as substrate after 40 mins by FRET-based assay

Eur J Med Chem 123: 631-638 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.073
BindingDB Entry DOI: 10.7270/Q2FT8P1P
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50104435
PNG
(4-(6-Guanidino-hexanoyloxy)-benzoic acid ethyl est...)
Show SMILES CCOC(=O)c1ccc(OC(=O)CCCCCNC(N)=N)cc1
Show InChI InChI=1S/C16H23N3O4/c1-2-22-15(21)12-7-9-13(10-8-12)23-14(20)6-4-3-5-11-19-16(17)18/h7-10H,2-6,11H2,1H3,(H4,17,18,19)
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n/an/a 687n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human plasma thrombin using pyroGlu-Pro-Arg-pNA-HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Cysteine protease ATG4B


(Homo sapiens (Human))		BDBM60996
PNG
(5-[(3-carboxy-4-hydroxy-phenyl)-(3-carboxy-4-keto-...)
Show SMILES [#8]-[#6](=O)-[#6]-1=[#6]\[#6](-[#6]=[#6]-[#6]-1=O)=[#6](\c1ccc(-[#8])c(c1)-[#6](-[#8])=O)-c1ccc(-[#8])c(c1)-[#6](-[#8])=O |c:6,t:3|
Show InChI InChI=1S/C22H14O9/c23-16-4-1-10(7-13(16)20(26)27)19(11-2-5-17(24)14(8-11)21(28)29)12-3-6-18(25)15(9-12)22(30)31/h1-9,23-24H,(H,26,27)(H,28,29)(H,30,31)
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n/an/a 1.30E+3n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of Atg4B (unknown origin) using YFP-LC3B-EmGFP as substrate after 40 mins by FRET-based assay

Eur J Med Chem 123: 631-638 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.073
BindingDB Entry DOI: 10.7270/Q2FT8P1P
More data for this
Ligand-Target Pair
Plasma kallikrein


(Homo sapiens (Human))		BDBM50363655
PNG
(CHEMBL1945236)
Show SMILES NC(=N)c1ccc(\C=C2\N=C(OC2=O)c2ccccc2)cc1 |c:9|
Show InChI InChI=1S/C17H13N3O2/c18-15(19)12-8-6-11(7-9-12)10-14-17(21)22-16(20-14)13-4-2-1-3-5-13/h1-10H,(H3,18,19)/b14-10+
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n/an/a 1.34E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human plasma kallikrein using D-Pro-Phe-Arg-pNA-2HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Plasma kallikrein


(Homo sapiens (Human))		BDBM50104435
PNG
(4-(6-Guanidino-hexanoyloxy)-benzoic acid ethyl est...)
Show SMILES CCOC(=O)c1ccc(OC(=O)CCCCCNC(N)=N)cc1
Show InChI InChI=1S/C16H23N3O4/c1-2-22-15(21)12-7-9-13(10-8-12)23-14(20)6-4-3-5-11-19-16(17)18/h7-10H,2-6,11H2,1H3,(H4,17,18,19)
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n/an/a 1.35E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human plasma kallikrein using D-Pro-Phe-Arg-pNA-2HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))		BDBM50104435
PNG
(4-(6-Guanidino-hexanoyloxy)-benzoic acid ethyl est...)
Show SMILES CCOC(=O)c1ccc(OC(=O)CCCCCNC(N)=N)cc1
Show InChI InChI=1S/C16H23N3O4/c1-2-22-15(21)12-7-9-13(10-8-12)23-14(20)6-4-3-5-11-19-16(17)18/h7-10H,2-6,11H2,1H3,(H4,17,18,19)
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n/an/a 1.55E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human plasma plasmin using pyroGlu-Pro-Arg-pNA-HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Cysteine protease ATG4B


(Homo sapiens (Human))		BDBM33413
PNG
(benzo[7]annulene-8-carboxylic acid, 5)
Show SMILES OC(=O)c1cc(O)c(=O)c2c(O)c(O)ccc2c1
Show InChI InChI=1S/C12H8O6/c13-7-2-1-5-3-6(12(17)18)4-8(14)11(16)9(5)10(7)15/h1-4,13,15H,(H,14,16)(H,17,18)
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n/an/a 2.30E+3n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of wild type recombinant Atg4B (unknown origin) expressed in Escherichia coli BL21 DE3 using N-terminal His6-tagged LC3B-PLA2 as substrate...

Eur J Med Chem 123: 631-638 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.073
BindingDB Entry DOI: 10.7270/Q2FT8P1P
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))		BDBM50104435
PNG
(4-(6-Guanidino-hexanoyloxy)-benzoic acid ethyl est...)
Show SMILES CCOC(=O)c1ccc(OC(=O)CCCCCNC(N)=N)cc1
Show InChI InChI=1S/C16H23N3O4/c1-2-22-15(21)12-7-9-13(10-8-12)23-14(20)6-4-3-5-11-19-16(17)18/h7-10H,2-6,11H2,1H3,(H4,17,18,19)
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n/an/a 4.61E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of purified human factor 10a using Suc-Ile-Glu(gammaPip)-GlyArg-pNa-HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Cysteine protease ATG4B


(Homo sapiens (Human))		BDBM4078
PNG
(6,7,13,14-tetrahydroxy-2,9-dioxatetracyclo[6.6.2.0...)
Show SMILES Oc1cc2c3c(oc(=O)c4cc(O)c(O)c(oc2=O)c34)c1O
Show InChI InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18H
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n/an/a 5.50E+3n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of wild type recombinant Atg4B (unknown origin) expressed in Escherichia coli BL21 DE3 using N-terminal His6-tagged LC3B-PLA2 as substrate...

Eur J Med Chem 123: 631-638 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.073
BindingDB Entry DOI: 10.7270/Q2FT8P1P
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))		BDBM50363655
PNG
(CHEMBL1945236)
Show SMILES NC(=N)c1ccc(\C=C2\N=C(OC2=O)c2ccccc2)cc1 |c:9|
Show InChI InChI=1S/C17H13N3O2/c18-15(19)12-8-6-11(7-9-12)10-14-17(21)22-16(20-14)13-4-2-1-3-5-13/h1-10H,(H3,18,19)/b14-10+
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n/an/a 6.47E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of purified human factor 10a using Suc-Ile-Glu(gammaPip)-GlyArg-pNa-HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499906
PNG
(CHEMBL3742152)
Show SMILES CCCCNC(=O)c1ccn2c(NCc3ccc(NC(N)=N)cc3)c(nc2c1)-c1cccnc1
Show InChI InChI=1S/C25H28N8O/c1-2-3-12-29-24(34)18-10-13-33-21(14-18)32-22(19-5-4-11-28-16-19)23(33)30-15-17-6-8-20(9-7-17)31-25(26)27/h4-11,13-14,16,30H,2-3,12,15H2,1H3,(H,29,34)(H4,26,27,31)
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n/an/a 6.89E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50363655
PNG
(CHEMBL1945236)
Show SMILES NC(=N)c1ccc(\C=C2\N=C(OC2=O)c2ccccc2)cc1 |c:9|
Show InChI InChI=1S/C17H13N3O2/c18-15(19)12-8-6-11(7-9-12)10-14-17(21)22-16(20-14)13-4-2-1-3-5-13/h1-10H,(H3,18,19)/b14-10+
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n/an/a 8.67E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499912
PNG
(CHEMBL3740931)
Show SMILES NC(=N)Nc1ccc(CNc2cnc3ccccn23)cc1
Show InChI InChI=1S/C15H16N6/c16-15(17)20-12-6-4-11(5-7-12)9-18-14-10-19-13-3-1-2-8-21(13)14/h1-8,10,18H,9H2,(H4,16,17,20)
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n/an/a 9.04E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499933
PNG
(CHEMBL3740914)
Show SMILES NCc1nc2ccccn2c1NCc1ccc(NC(N)=N)cc1
Show InChI InChI=1S/C16H19N7/c17-9-13-15(23-8-2-1-3-14(23)22-13)20-10-11-4-6-12(7-5-11)21-16(18)19/h1-8,20H,9-10,17H2,(H4,18,19,21)
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n/an/a 9.30E+3n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM16173
PNG
(3,5-diamino-6-chloro-N-(diaminomethylene)pyrazinam...)
Show SMILES NC(=N)NC(=O)c1nc(Cl)c(N)nc1N
Show InChI InChI=1S/C6H8ClN7O/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11/h(H4,8,9,13)(H4,10,11,14,15)
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n/an/a 1.20E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499915
PNG
(CHEMBL3740642)
Show SMILES COC(=O)c1ccn2c(NCc3ccc(NC(N)=N)cc3)c(nc2c1)-c1cccnc1
Show InChI InChI=1S/C22H21N7O2/c1-31-21(30)15-8-10-29-18(11-15)28-19(16-3-2-9-25-13-16)20(29)26-12-14-4-6-17(7-5-14)27-22(23)24/h2-11,13,26H,12H2,1H3,(H4,23,24,27)
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n/an/a 1.50E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))		BDBM50104435
PNG
(4-(6-Guanidino-hexanoyloxy)-benzoic acid ethyl est...)
Show SMILES CCOC(=O)c1ccc(OC(=O)CCCCCNC(N)=N)cc1
Show InChI InChI=1S/C16H23N3O4/c1-2-22-15(21)12-7-9-13(10-8-12)23-14(20)6-4-3-5-11-19-16(17)18/h7-10H,2-6,11H2,1H3,(H4,17,18,19)
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n/an/a 1.54E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human tPA using H-D-Ile-Pro-L-Arg-pNA-2HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499922
PNG
(CHEMBL3740676)
Show SMILES NC(=N)Nc1ccc(CNc2c(Cc3cccc(Cl)c3)nc3ccccn23)cc1
Show InChI InChI=1S/C22H21ClN6/c23-17-5-3-4-16(12-17)13-19-21(29-11-2-1-6-20(29)28-19)26-14-15-7-9-18(10-8-15)27-22(24)25/h1-12,26H,13-14H2,(H4,24,25,27)
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n/an/a 1.80E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499911
PNG
(CHEMBL3739833)
Show SMILES NC(=N)Nc1ccc(CCNc2cnc3ccccn23)cc1
Show InChI InChI=1S/C16H18N6/c17-16(18)21-13-6-4-12(5-7-13)8-9-19-15-11-20-14-3-1-2-10-22(14)15/h1-7,10-11,19H,8-9H2,(H4,17,18,21)
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n/an/a 1.94E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499905
PNG
(CHEMBL3741004)
Show SMILES Cc1ccc2nc(c(NCc3ccc(NC(N)=N)cc3)n2c1)-c1cccnc1
Show InChI InChI=1S/C21H21N7/c1-14-4-9-18-27-19(16-3-2-10-24-12-16)20(28(18)13-14)25-11-15-5-7-17(8-6-15)26-21(22)23/h2-10,12-13,25H,11H2,1H3,(H4,22,23,26)
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n/an/a 2.39E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499917
PNG
(CHEMBL3739519)
Show SMILES NC(=N)Nc1ccc(CNc2c(nc3cc(ccn23)C(O)=O)-c2cccnc2)cc1
Show InChI InChI=1S/C21H19N7O2/c22-21(23)26-16-5-3-13(4-6-16)11-25-19-18(15-2-1-8-24-12-15)27-17-10-14(20(29)30)7-9-28(17)19/h1-10,12,25H,11H2,(H,29,30)(H4,22,23,26)
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n/an/a 2.69E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499925
PNG
(CHEMBL3741887)
Show SMILES NC(=N)Nc1ccc(CNc2c(nc3ccc(cn23)C(N)=O)-c2cccnc2)cc1
Show InChI InChI=1S/C21H20N8O/c22-19(30)15-5-8-17-28-18(14-2-1-9-25-11-14)20(29(17)12-15)26-10-13-3-6-16(7-4-13)27-21(23)24/h1-9,11-12,26H,10H2,(H2,22,30)(H4,23,24,27)
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n/an/a 2.73E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499921
PNG
(CHEMBL3740294)
Show SMILES Cc1cccn2c(NCc3ccc(NC(N)=N)cc3)c(nc12)-c1cccnc1
Show InChI InChI=1S/C21H21N7/c1-14-4-3-11-28-19(14)27-18(16-5-2-10-24-13-16)20(28)25-12-15-6-8-17(9-7-15)26-21(22)23/h2-11,13,25H,12H2,1H3,(H4,22,23,26)
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n/an/a 2.74E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499926
PNG
(CHEMBL3740145)
Show SMILES NC(=N)Nc1ccc(CNc2c(nc3ccccn23)-c2ccccc2)cc1
Show InChI InChI=1S/C21H20N6/c22-21(23)25-17-11-9-15(10-12-17)14-24-20-19(16-6-2-1-3-7-16)26-18-8-4-5-13-27(18)20/h1-13,24H,14H2,(H4,22,23,25)
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n/an/a 3.02E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499929
PNG
(CHEMBL3741697)
Show SMILES NC(=N)Nc1ccc(CNc2c(Cc3ccccc3)nc3ccccn23)cc1
Show InChI InChI=1S/C22H22N6/c23-22(24)26-18-11-9-17(10-12-18)15-25-21-19(14-16-6-2-1-3-7-16)27-20-8-4-5-13-28(20)21/h1-13,25H,14-15H2,(H4,23,24,26)
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n/an/a 3.03E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Cysteine protease ATG4B


(Homo sapiens (Human))		BDBM60996
PNG
(5-[(3-carboxy-4-hydroxy-phenyl)-(3-carboxy-4-keto-...)
Show SMILES [#8]-[#6](=O)-[#6]-1=[#6]\[#6](-[#6]=[#6]-[#6]-1=O)=[#6](\c1ccc(-[#8])c(c1)-[#6](-[#8])=O)-c1ccc(-[#8])c(c1)-[#6](-[#8])=O |c:6,t:3|
Show InChI InChI=1S/C22H14O9/c23-16-4-1-10(7-13(16)20(26)27)19(11-2-5-17(24)14(8-11)21(28)29)12-3-6-18(25)15(9-12)22(30)31/h1-9,23-24H,(H,26,27)(H,28,29)(H,30,31)
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n/an/a 3.80E+4n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged Atg4B expressed in Escherichia coli using LC3B-GST as substrate after 6 mins by SDS-PAGE assay

Eur J Med Chem 123: 631-638 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.073
BindingDB Entry DOI: 10.7270/Q2FT8P1P
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499908
PNG
(CHEMBL3742000)
Show SMILES CCc1nc2ccccn2c1NCc1ccc(NC(N)=N)cc1
Show InChI InChI=1S/C17H20N6/c1-2-14-16(23-10-4-3-5-15(23)22-14)20-11-12-6-8-13(9-7-12)21-17(18)19/h3-10,20H,2,11H2,1H3,(H4,18,19,21)
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n/an/a 4.85E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Cysteine protease ATG4B


(Homo sapiens (Human))		BDBM34545
PNG
(MLS000104342 | N-(2-pyridinyl)-2-pyridinecarbothio...)
Show SMILES S=C(Nc1ccccn1)c1ccccn1
Show InChI InChI=1S/C11H9N3S/c15-11(9-5-1-3-7-12-9)14-10-6-2-4-8-13-10/h1-8H,(H,13,14,15)
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n/an/a 5.10E+4n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of Atg4B (unknown origin) using LC3B-GST as substrate preincubated for 24 hrs followed by substrate addition measured for 3 mins by SDS-PA...

Eur J Med Chem 123: 631-638 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.073
BindingDB Entry DOI: 10.7270/Q2FT8P1P
More data for this
Ligand-Target Pair
Coagulation factor X


(Homo sapiens (Human))		BDBM50499919
PNG
(CHEMBL3740904)
Show SMILES NC(=N)Nc1ccc(CNc2cnc3cc(ccn23)C(=O)NCCO)cc1
Show InChI InChI=1S/C18H21N7O2/c19-18(20)24-14-3-1-12(2-4-14)10-22-16-11-23-15-9-13(5-7-25(15)16)17(27)21-6-8-26/h1-5,7,9,11,22,26H,6,8,10H2,(H,21,27)(H4,19,20,24)
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n/an/a 5.16E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of purified human factor 10a using Suc-Ile-Glu(gammaPip)-GlyArg-pNa-HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499931
PNG
(CHEMBL3740795)
Show SMILES NC(=N)Nc1ccc(CCNc2c(nc3cnccn23)-c2cccc(Cl)c2)cc1
Show InChI InChI=1S/C21H20ClN7/c22-16-3-1-2-15(12-16)19-20(29-11-10-25-13-18(29)28-19)26-9-8-14-4-6-17(7-5-14)27-21(23)24/h1-7,10-13,26H,8-9H2,(H4,23,24,27)
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n/an/a 5.38E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))		BDBM50363655
PNG
(CHEMBL1945236)
Show SMILES NC(=N)c1ccc(\C=C2\N=C(OC2=O)c2ccccc2)cc1 |c:9|
Show InChI InChI=1S/C17H13N3O2/c18-15(19)12-8-6-11(7-9-12)10-14-17(21)22-16(20-14)13-4-2-1-3-5-13/h1-10H,(H3,18,19)/b14-10+
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n/an/a 5.61E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human plasma thrombin using pyroGlu-Pro-Arg-pNA-HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Cysteine protease ATG4B


(Homo sapiens (Human))		BDBM50060874
PNG
(1,3,4,6,8,13-hexahydroxy-10,11-dimethylphenanthro[...)
Show SMILES Cc1cc(O)c2c3c1c1c(C)cc(O)c4c1c1c3c3c(c(O)cc(O)c3c2=O)c2c(O)cc(O)c(c12)c4=O
Show InChI InChI=1S/C30H16O8/c1-7-3-9(31)19-23-15(7)16-8(2)4-10(32)20-24(16)28-26-18(12(34)6-14(36)22(26)30(20)38)17-11(33)5-13(35)21(29(19)37)25(17)27(23)28/h3-6,31-36H,1-2H3
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n/an/a 5.70E+4n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of Atg4B (unknown origin) using YFP-LC3B-EmGFP as substrate after 40 mins by FRET-based assay

Eur J Med Chem 123: 631-638 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.073
BindingDB Entry DOI: 10.7270/Q2FT8P1P
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499930
PNG
(CHEMBL3740195)
Show SMILES NC(=N)Nc1ccc(CNc2c(nc3ccc(F)cn23)-c2cccnc2)cc1
Show InChI InChI=1S/C20H18FN7/c21-15-5-8-17-27-18(14-2-1-9-24-11-14)19(28(17)12-15)25-10-13-3-6-16(7-4-13)26-20(22)23/h1-9,11-12,25H,10H2,(H4,22,23,26)
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n/an/a 5.76E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499903
PNG
(CHEMBL3741341)
Show SMILES CCCCNC(=O)c1ccc2nc(c(NCc3ccc(NC(N)=N)cc3)n2c1)-c1cccnc1
Show InChI InChI=1S/C25H28N8O/c1-2-3-13-29-24(34)19-8-11-21-32-22(18-5-4-12-28-15-18)23(33(21)16-19)30-14-17-6-9-20(10-7-17)31-25(26)27/h4-12,15-16,30H,2-3,13-14H2,1H3,(H,29,34)(H4,26,27,31)
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n/an/a 6.08E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499918
PNG
(CHEMBL3739939)
Show SMILES CCc1ccc(cc1)-c1nc2ccccn2c1NCc1ccc(NC(N)=N)cc1
Show InChI InChI=1S/C23H24N6/c1-2-16-6-10-18(11-7-16)21-22(29-14-4-3-5-20(29)28-21)26-15-17-8-12-19(13-9-17)27-23(24)25/h3-14,26H,2,15H2,1H3,(H4,24,25,27)
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n/an/a 6.39E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Tissue-type plasminogen activator


(Homo sapiens (Human))		BDBM50363655
PNG
(CHEMBL1945236)
Show SMILES NC(=N)c1ccc(\C=C2\N=C(OC2=O)c2ccccc2)cc1 |c:9|
Show InChI InChI=1S/C17H13N3O2/c18-15(19)12-8-6-11(7-9-12)10-14-17(21)22-16(20-14)13-4-2-1-3-5-13/h1-10H,(H3,18,19)/b14-10+
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n/an/a 6.85E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human tPA using H-D-Ile-Pro-L-Arg-pNA-2HCl as substrate measured for 5 mins by spectrophotometric assay

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
Urokinase-type plasminogen activator


(Homo sapiens (Human))		BDBM50499928
PNG
(CHEMBL3741486)
Show SMILES NC(=N)Nc1ccc(CNc2c(nc3ccccn23)-c2cc(Cl)cc(Cl)c2)cc1
Show InChI InChI=1S/C21H18Cl2N6/c22-15-9-14(10-16(23)11-15)19-20(29-8-2-1-3-18(29)28-19)26-12-13-4-6-17(7-5-13)27-21(24)25/h1-11,26H,12H2,(H4,24,25,27)
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n/an/a 9.92E+4n/an/an/an/an/an/a



University of Antwerp (UA)

Curated by ChEMBL


Assay Description
Inhibition of human uPA using pyro-Glu-Gly-Arg-pNA as substrate assessed as para-nitroaniline release from substrate measured for 5 mins by spectroph...

J Med Chem 58: 9238-57 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01171
BindingDB Entry DOI: 10.7270/Q241713M
More data for this
Ligand-Target Pair
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