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Compile Data Set for Download or QSAR

Found 120 hits Enz. Inhib. hit(s) with Target = 'Matriptase'   
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
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394264
PNG
(CHEMBL2159361)
Show SMILES NC(=[NH2+])c1cccc(c1)S(=O)(=O)NCCCC(=O)Nc1cccc(c1)C(O)=O
Show InChI InChI=1S/C18H20N4O5S/c19-17(20)12-4-2-7-15(11-12)28(26,27)21-9-3-8-16(23)22-14-6-1-5-13(10-14)18(24)25/h1-2,4-7,10-11,21H,3,8-9H2,(H3,19,20)(H,22,23)(H,24,25)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394295
PNG
(CHEMBL2159392)
Show SMILES COc1ccc(CNC(=O)CCCNS(=O)(=O)c2cccc(c2)C(N)=N)cc1OC
Show InChI InChI=1S/C20H26N4O5S/c1-28-17-9-8-14(11-18(17)29-2)13-23-19(25)7-4-10-24-30(26,27)16-6-3-5-15(12-16)20(21)22/h3,5-6,8-9,11-12,24H,4,7,10,13H2,1-2H3,(H3,21,22)(H,23,25)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394271
PNG
(CHEMBL2159299)
Show SMILES NC(=[NH2+])c1ccc(cc1)S(=O)(=O)NCCCC(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C18H20N4O5S/c19-17(20)12-5-9-15(10-6-12)28(26,27)21-11-1-2-16(23)22-14-7-3-13(4-8-14)18(24)25/h3-10,21H,1-2,11H2,(H3,19,20)(H,22,23)(H,24,25)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394272
PNG
(CHEMBL2159298)
Show SMILES NC(=[NH2+])c1ccc(cc1)S(=O)(=O)NCCC(=O)Nc1cccc(c1)C(O)=O
Show InChI InChI=1S/C17H18N4O5S/c18-16(19)11-4-6-14(7-5-11)27(25,26)20-9-8-15(22)21-13-3-1-2-12(10-13)17(23)24/h1-7,10,20H,8-9H2,(H3,18,19)(H,21,22)(H,23,24)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394273
PNG
(CHEMBL2159297)
Show SMILES NC(=[NH2+])c1ccc(cc1)S(=O)(=O)NCCC(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C17H18N4O5S/c18-16(19)11-3-7-14(8-4-11)27(25,26)20-10-9-15(22)21-13-5-1-12(2-6-13)17(23)24/h1-8,20H,9-10H2,(H3,18,19)(H,21,22)(H,23,24)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394274
PNG
(CHEMBL2159296)
Show SMILES NC(=[NH2+])c1ccc(cc1)S(=O)(=O)NCC(=O)Nc1cccc(c1)C(O)=O
Show InChI InChI=1S/C16H16N4O5S/c17-15(18)10-4-6-13(7-5-10)26(24,25)19-9-14(21)20-12-3-1-2-11(8-12)16(22)23/h1-8,19H,9H2,(H3,17,18)(H,20,21)(H,22,23)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394275
PNG
(CHEMBL2159295)
Show SMILES NC(=[NH2+])c1ccc(cc1)S(=O)(=O)NCC(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C16H16N4O5S/c17-15(18)10-3-7-13(8-4-10)26(24,25)19-9-14(21)20-12-5-1-11(2-6-12)16(22)23/h1-8,19H,9H2,(H3,17,18)(H,20,21)(H,22,23)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394276
PNG
(CHEMBL2159294)
Show SMILES CC(C)(C)OC(=O)c1cccc(NC(=O)CCCNS(=O)(=O)c2cccc(c2)C(N)=[NH2+])c1
Show InChI InChI=1S/C22H28N4O5S/c1-22(2,3)31-21(28)16-8-4-9-17(13-16)26-19(27)11-6-12-25-32(29,30)18-10-5-7-15(14-18)20(23)24/h4-5,7-10,13-14,25H,6,11-12H2,1-3H3,(H3,23,24)(H,26,27)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394282
PNG
(CHEMBL2159288)
Show SMILES CC(C)(C)OC(=O)c1cccc(NC(=O)CCCNS(=O)(=O)c2ccc(cc2)C(N)=[NH2+])c1
Show InChI InChI=1S/C22H28N4O5S/c1-22(2,3)31-21(28)16-6-4-7-17(14-16)26-19(27)8-5-13-25-32(29,30)18-11-9-15(10-12-18)20(23)24/h4,6-7,9-12,14,25H,5,8,13H2,1-3H3,(H3,23,24)(H,26,27)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394284
PNG
(CHEMBL2159286)
Show SMILES CC(C)(C)OC(=O)c1cccc(NC(=O)CCNS(=O)(=O)c2ccc(cc2)C(N)=[NH2+])c1
Show InChI InChI=1S/C21H26N4O5S/c1-21(2,3)30-20(27)15-5-4-6-16(13-15)25-18(26)11-12-24-31(28,29)17-9-7-14(8-10-17)19(22)23/h4-10,13,24H,11-12H2,1-3H3,(H3,22,23)(H,25,26)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394285
PNG
(CHEMBL2159285)
Show SMILES CC(C)(C)OC(=O)c1ccc(NC(=O)CCNS(=O)(=O)c2ccc(cc2)C(N)=[NH2+])cc1
Show InChI InChI=1S/C21H26N4O5S/c1-21(2,3)30-20(27)15-4-8-16(9-5-15)25-18(26)12-13-24-31(28,29)17-10-6-14(7-11-17)19(22)23/h4-11,24H,12-13H2,1-3H3,(H3,22,23)(H,25,26)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394286
PNG
(CHEMBL2159284)
Show SMILES CC(C)(C)OC(=O)c1cccc(NC(=O)CNS(=O)(=O)c2ccc(cc2)C(N)=[NH2+])c1
Show InChI InChI=1S/C20H24N4O5S/c1-20(2,3)29-19(26)14-5-4-6-15(11-14)24-17(25)12-23-30(27,28)16-9-7-13(8-10-16)18(21)22/h4-11,23H,12H2,1-3H3,(H3,21,22)(H,24,25)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394297
PNG
(CHEMBL2159390)
Show SMILES COc1ccc(NC(=O)CCCNS(=O)(=O)c2cccc(c2)C(N)=N)cc1OC
Show InChI InChI=1S/C19H24N4O5S/c1-27-16-9-8-14(12-17(16)28-2)23-18(24)7-4-10-22-29(25,26)15-6-3-5-13(11-15)19(20)21/h3,5-6,8-9,11-12,22H,4,7,10H2,1-2H3,(H3,20,21)(H,23,24)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394301
PNG
(CHEMBL2159386)
Show SMILES COc1ccc(CNC(=O)CCCNS(=O)(=O)c2ccc(cc2)C(N)=N)cc1OC
Show InChI InChI=1S/C20H26N4O5S/c1-28-17-10-5-14(12-18(17)29-2)13-23-19(25)4-3-11-24-30(26,27)16-8-6-15(7-9-16)20(21)22/h5-10,12,24H,3-4,11,13H2,1-2H3,(H3,21,22)(H,23,25)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394302
PNG
(CHEMBL2159385)
Show SMILES COc1ccc(CNC(=O)CCNS(=O)(=O)c2ccc(cc2)C(N)=N)cc1OC
Show InChI InChI=1S/C19H24N4O5S/c1-27-16-8-3-13(11-17(16)28-2)12-22-18(24)9-10-23-29(25,26)15-6-4-14(5-7-15)19(20)21/h3-8,11,23H,9-10,12H2,1-2H3,(H3,20,21)(H,22,24)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394303
PNG
(CHEMBL2159384)
Show SMILES COc1ccc(NC(=O)CCCNS(=O)(=O)c2ccc(cc2)C(N)=N)cc1OC
Show InChI InChI=1S/C19H24N4O5S/c1-27-16-10-7-14(12-17(16)28-2)23-18(24)4-3-11-22-29(25,26)15-8-5-13(6-9-15)19(20)21/h5-10,12,22H,3-4,11H2,1-2H3,(H3,20,21)(H,23,24)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394304
PNG
(CHEMBL2159383)
Show SMILES COc1ccc(CNC(=O)CNS(=O)(=O)c2ccc(cc2)C(N)=N)cc1OC
Show InChI InChI=1S/C18H22N4O5S/c1-26-15-8-3-12(9-16(15)27-2)10-21-17(23)11-22-28(24,25)14-6-4-13(5-7-14)18(19)20/h3-9,22H,10-11H2,1-2H3,(H3,19,20)(H,21,23)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394305
PNG
(CHEMBL2159382)
Show SMILES COc1ccc(NC(=O)CCNS(=O)(=O)c2ccc(cc2)C(N)=N)cc1OC
Show InChI InChI=1S/C18H22N4O5S/c1-26-15-8-5-13(11-16(15)27-2)22-17(23)9-10-21-28(24,25)14-6-3-12(4-7-14)18(19)20/h3-8,11,21H,9-10H2,1-2H3,(H3,19,20)(H,22,23)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394307
PNG
(CHEMBL2159380)
Show SMILES COc1ccc(CNS(=O)(=O)c2cccc(c2)C(N)=N)cc1OC
Show InChI InChI=1S/C16H19N3O4S/c1-22-14-7-6-11(8-15(14)23-2)10-19-24(20,21)13-5-3-4-12(9-13)16(17)18/h3-9,19H,10H2,1-2H3,(H3,17,18)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394308
PNG
(CHEMBL2159379)
Show SMILES COc1cccc(CNS(=O)(=O)c2cccc(c2)C(N)=N)c1
Show InChI InChI=1S/C15H17N3O3S/c1-21-13-6-2-4-11(8-13)10-18-22(19,20)14-7-3-5-12(9-14)15(16)17/h2-9,18H,10H2,1H3,(H3,16,17)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394309
PNG
(CHEMBL2159378)
Show SMILES COc1ccc(CNS(=O)(=O)c2cccc(c2)C(N)=N)cc1
Show InChI InChI=1S/C15H17N3O3S/c1-21-13-7-5-11(6-8-13)10-18-22(19,20)14-4-2-3-12(9-14)15(16)17/h2-9,18H,10H2,1H3,(H3,16,17)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394310
PNG
(CHEMBL2159377)
Show SMILES NC(=N)c1cccc(c1)S(=O)(=O)NCc1ccccc1
Show InChI InChI=1S/C14H15N3O2S/c15-14(16)12-7-4-8-13(9-12)20(18,19)17-10-11-5-2-1-3-6-11/h1-9,17H,10H2,(H3,15,16)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394311
PNG
(CHEMBL2159376)
Show SMILES COc1ccc(NS(=O)(=O)c2cccc(c2)C(N)=N)cc1OC
Show InChI InChI=1S/C15H17N3O4S/c1-21-13-7-6-11(9-14(13)22-2)18-23(19,20)12-5-3-4-10(8-12)15(16)17/h3-9,18H,1-2H3,(H3,16,17)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394312
PNG
(CHEMBL2159375)
Show SMILES COc1cccc(NS(=O)(=O)c2cccc(c2)C(N)=N)c1
Show InChI InChI=1S/C14H15N3O3S/c1-20-12-6-3-5-11(9-12)17-21(18,19)13-7-2-4-10(8-13)14(15)16/h2-9,17H,1H3,(H3,15,16)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394313
PNG
(CHEMBL2159374)
Show SMILES COc1ccc(NS(=O)(=O)c2cccc(c2)C(N)=N)cc1
Show InChI InChI=1S/C14H15N3O3S/c1-20-12-7-5-11(6-8-12)17-21(18,19)13-4-2-3-10(9-13)14(15)16/h2-9,17H,1H3,(H3,15,16)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394314
PNG
(CHEMBL2159373)
Show SMILES NC(=N)c1cccc(c1)S(=O)(=O)Nc1ccccc1
Show InChI InChI=1S/C13H13N3O2S/c14-13(15)10-5-4-8-12(9-10)19(17,18)16-11-6-2-1-3-7-11/h1-9,16H,(H3,14,15)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394315
PNG
(CHEMBL2159372)
Show SMILES COc1ccc(CNS(=O)(=O)c2ccc(cc2)C(N)=N)cc1OC
Show InChI InChI=1S/C16H19N3O4S/c1-22-14-8-3-11(9-15(14)23-2)10-19-24(20,21)13-6-4-12(5-7-13)16(17)18/h3-9,19H,10H2,1-2H3,(H3,17,18)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394316
PNG
(CHEMBL2159371)
Show SMILES COc1cccc(CNS(=O)(=O)c2ccc(cc2)C(N)=N)c1
Show InChI InChI=1S/C15H17N3O3S/c1-21-13-4-2-3-11(9-13)10-18-22(19,20)14-7-5-12(6-8-14)15(16)17/h2-9,18H,10H2,1H3,(H3,16,17)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394317
PNG
(CHEMBL2159370)
Show SMILES COc1ccc(CNS(=O)(=O)c2ccc(cc2)C(N)=N)cc1
Show InChI InChI=1S/C15H17N3O3S/c1-21-13-6-2-11(3-7-13)10-18-22(19,20)14-8-4-12(5-9-14)15(16)17/h2-9,18H,10H2,1H3,(H3,16,17)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394318
PNG
(CHEMBL2159369)
Show SMILES NC(=N)c1ccc(cc1)S(=O)(=O)NCc1ccccc1
Show InChI InChI=1S/C14H15N3O2S/c15-14(16)12-6-8-13(9-7-12)20(18,19)17-10-11-4-2-1-3-5-11/h1-9,17H,10H2,(H3,15,16)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394319
PNG
(CHEMBL2159368)
Show SMILES COc1ccc(NS(=O)(=O)c2ccc(cc2)C(N)=N)cc1OC
Show InChI InChI=1S/C15H17N3O4S/c1-21-13-8-5-11(9-14(13)22-2)18-23(19,20)12-6-3-10(4-7-12)15(16)17/h3-9,18H,1-2H3,(H3,16,17)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394320
PNG
(CHEMBL2159367)
Show SMILES COc1cccc(NS(=O)(=O)c2ccc(cc2)C(N)=N)c1
Show InChI InChI=1S/C14H15N3O3S/c1-20-12-4-2-3-11(9-12)17-21(18,19)13-7-5-10(6-8-13)14(15)16/h2-9,17H,1H3,(H3,15,16)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394321
PNG
(CHEMBL2159366)
Show SMILES COc1ccc(NS(=O)(=O)c2ccc(cc2)C(N)=N)cc1
Show InChI InChI=1S/C14H15N3O3S/c1-20-12-6-4-11(5-7-12)17-21(18,19)13-8-2-10(3-9-13)14(15)16/h2-9,17H,1H3,(H3,15,16)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50394270
PNG
(CHEMBL2159300)
Show SMILES NC(=[NH2+])c1ccc(cc1)S(=O)(=O)NCCCC(=O)Nc1cccc(c1)C(O)=O
Show InChI InChI=1S/C18H20N4O5S/c19-17(20)12-6-8-15(9-7-12)28(26,27)21-10-2-5-16(23)22-14-4-1-3-13(11-14)18(24)25/h1,3-4,6-9,11,21H,2,5,10H2,(H3,19,20)(H,22,23)(H,24,25)/p+1
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibition of human matriptase-2 expressed in HEK-MT2 cells using fluorogenic Boc- Gln-Ala-Arg-NH-Mec as substrate measured over 400 secs by spectrop...


Bioorg Med Chem 20: 6489-505 (2012)


Article DOI: 10.1016/j.bmc.2012.08.042
BindingDB Entry DOI: 10.7270/Q2SB46VD
More data for this
Ligand-Target Pair
Matriptase


(Homo sapiens (Human))
BDBM236490
PNG
(US9365853, 1)
Show SMILES C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C27H42N12O5S/c1-14(36-24(44)18(10-11-20(29)40)38-23(43)15(28)6-4-12-34-26(30)31)22(42)37-17(8-5-13-35-27(32)33)21(41)25-39-16-7-2-3-9-19(16)45-25/h2-3,7,9,14-15,17-18H,4-6,8,10-13,28H2,1H3,(H2,29,40)(H,36,44)(H,37,42)(H,38,43)(H4,30,31,34)(H4,32,33,35)/t14-,15+,17-,18-/m0/s1
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0.0110n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Enzymatic assays were performed in the following reaction buffer: 50 mM HEPES, pH 7.4 containing 500 μg/ml bovine serum albumin. Enzyme activiti...


US Patent US9365853 (2016)


BindingDB Entry DOI: 10.7270/Q28W3C6F
More data for this
Ligand-Target Pair
Matriptase


(Homo sapiens (Human))
BDBM236493
PNG
(US9365853, 4)
Show SMILES C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C21H30N8O4S/c1-11(27-19(33)12(22)8-9-16(23)30)18(32)28-14(6-4-10-26-21(24)25)17(31)20-29-13-5-2-3-7-15(13)34-20/h2-3,5,7,11-12,14H,4,6,8-10,22H2,1H3,(H2,23,30)(H,27,33)(H,28,32)(H4,24,25,26)/t11-,12-,14-/m0/s1
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0.0880n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Enzymatic assays were performed in the following reaction buffer: 50 mM HEPES, pH 7.4 containing 500 μg/ml bovine serum albumin. Enzyme activiti...


US Patent US9365853 (2016)


BindingDB Entry DOI: 10.7270/Q28W3C6F
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50032697
PNG
(CHEMBL3354675)
Show SMILES N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C33H46N12O6S/c34-20(5-3-15-40-32(36)37)28(49)43-23(13-14-26(35)47)29(50)44-24(17-18-9-11-19(46)12-10-18)30(51)42-22(7-4-16-41-33(38)39)27(48)31-45-21-6-1-2-8-25(21)52-31/h1-2,6,8-12,20,22-24,46H,3-5,7,13-17,34H2,(H2,35,47)(H,42,51)(H,43,49)(H,44,50)(H4,36,37,40)(H4,38,39,41)/t20-,22-,23-,24-/m0/s1
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0.740n/an/an/an/an/an/an/an/a



Universit£ de Sherbrooke

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matriptase-2 using Boc-Gln-Ala-Arg-AMC as substrate by microplate reader analysis


J Med Chem 57: 10198-204 (2014)


Article DOI: 10.1021/jm5015633
BindingDB Entry DOI: 10.7270/Q2DJ5H73
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50032706
PNG
(CHEMBL3354683)
Show SMILES N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C36H41N9O5S2/c37-24(17-21-18-41-25-7-2-1-6-23(21)25)32(48)44-29(19-51)34(50)43-28(16-20-11-13-22(46)14-12-20)33(49)42-27(9-5-15-40-36(38)39)31(47)35-45-26-8-3-4-10-30(26)52-35/h1-4,6-8,10-14,18,24,27-29,41,46,51H,5,9,15-17,19,37H2,(H,42,49)(H,43,50)(H,44,48)(H4,38,39,40)/t24-,27-,28-,29-/m0/s1
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1n/an/an/an/an/an/an/an/a



Universit£ de Sherbrooke

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matriptase-2 using Boc-Gln-Ala-Arg-AMC as substrate by microplate reader analysis


J Med Chem 57: 10198-204 (2014)


Article DOI: 10.1021/jm5015633
BindingDB Entry DOI: 10.7270/Q2DJ5H73
More data for this
Ligand-Target Pair
Matriptase


(Homo sapiens (Human))
BDBM236494
PNG
(US9365853, 5)
Show SMILES C[C@H](NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C18H24N6O3S/c1-10(22-11(2)25)16(27)23-13(7-5-9-21-18(19)20)15(26)17-24-12-6-3-4-8-14(12)28-17/h3-4,6,8,10,13H,5,7,9H2,1-2H3,(H,22,25)(H,23,27)(H4,19,20,21)/t10-,13-/m0/s1
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1.40n/an/an/an/an/an/an/an/a



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US Patent


Assay Description
Enzymatic assays were performed in the following reaction buffer: 50 mM HEPES, pH 7.4 containing 500 μg/ml bovine serum albumin. Enzyme activiti...


US Patent US9365853 (2016)


BindingDB Entry DOI: 10.7270/Q28W3C6F
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50032698
PNG
(CHEMBL3354676)
Show SMILES N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C33H46N12O5S/c34-20(10-6-16-40-32(36)37)28(48)43-23(14-15-26(35)46)29(49)44-24(18-19-8-2-1-3-9-19)30(50)42-22(12-7-17-41-33(38)39)27(47)31-45-21-11-4-5-13-25(21)51-31/h1-5,8-9,11,13,20,22-24H,6-7,10,12,14-18,34H2,(H2,35,46)(H,42,50)(H,43,48)(H,44,49)(H4,36,37,40)(H4,38,39,41)/t20-,22-,23-,24-/m0/s1
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1.40n/an/an/an/an/an/an/an/a



Universit£ de Sherbrooke

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matriptase-2 using Boc-Gln-Ala-Arg-AMC as substrate by microplate reader analysis


J Med Chem 57: 10198-204 (2014)


Article DOI: 10.1021/jm5015633
BindingDB Entry DOI: 10.7270/Q2DJ5H73
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50032708
PNG
(CHEMBL3354685)
Show SMILES CC(C)C[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C41H48N10O4S/c1-23(2)18-28(42)37(53)49-33(19-24-21-46-29-12-5-3-10-26(24)29)39(55)50-34(20-25-22-47-30-13-6-4-11-27(25)30)38(54)48-32(15-9-17-45-41(43)44)36(52)40-51-31-14-7-8-16-35(31)56-40/h3-8,10-14,16,21-23,28,32-34,46-47H,9,15,17-20,42H2,1-2H3,(H,48,54)(H,49,53)(H,50,55)(H4,43,44,45)/t28-,32-,33-,34-/m0/s1
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2n/an/an/an/an/an/an/an/a



Universit£ de Sherbrooke

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matriptase-2 using Boc-Gln-Ala-Arg-AMC as substrate by microplate reader analysis


J Med Chem 57: 10198-204 (2014)


Article DOI: 10.1021/jm5015633
BindingDB Entry DOI: 10.7270/Q2DJ5H73
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50032709
PNG
(CHEMBL3354686)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C28H45N11O5S/c1-15(2)13-19(37-23(42)16(29)7-5-11-34-27(30)31)24(43)38-20(14-40)25(44)36-18(9-6-12-35-28(32)33)22(41)26-39-17-8-3-4-10-21(17)45-26/h3-4,8,10,15-16,18-20,40H,5-7,9,11-14,29H2,1-2H3,(H,36,44)(H,37,42)(H,38,43)(H4,30,31,34)(H4,32,33,35)/t16-,18-,19-,20-/m0/s1
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2.5n/an/an/an/an/an/an/an/a



Universit£ de Sherbrooke

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matriptase-2 using Boc-Gln-Ala-Arg-AMC as substrate by microplate reader analysis


J Med Chem 57: 10198-204 (2014)


Article DOI: 10.1021/jm5015633
BindingDB Entry DOI: 10.7270/Q2DJ5H73
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50032707
PNG
(CHEMBL3354684)
Show SMILES CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C36H44N8O6S/c1-20(2)30(34(50)41-27(7-5-17-40-36(38)39)31(47)35-43-26-6-3-4-8-29(26)51-35)44-33(49)28(19-22-11-15-24(46)16-12-22)42-32(48)25(37)18-21-9-13-23(45)14-10-21/h3-4,6,8-16,20,25,27-28,30,45-46H,5,7,17-19,37H2,1-2H3,(H,41,50)(H,42,48)(H,44,49)(H4,38,39,40)/t25-,27-,28-,30-/m0/s1
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2.60n/an/an/an/an/an/an/an/a



Universit£ de Sherbrooke

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matriptase-2 using Boc-Gln-Ala-Arg-AMC as substrate by microplate reader analysis


J Med Chem 57: 10198-204 (2014)


Article DOI: 10.1021/jm5015633
BindingDB Entry DOI: 10.7270/Q2DJ5H73
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50420334
PNG
(CHEMBL2086421)
Show SMILES C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C27H42N12O5S/c1-14(36-24(44)18(10-11-20(29)40)38-23(43)15(28)6-4-12-34-26(30)31)22(42)37-17(8-5-13-35-27(32)33)21(41)25-39-16-7-2-3-9-19(16)45-25/h2-3,7,9,14-15,17-18H,4-6,8,10-13,28H2,1H3,(H2,29,40)(H,36,44)(H,37,42)(H,38,43)(H4,30,31,34)(H4,32,33,35)/t14-,15-,17-,18-/m0/s1
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3.30n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tight binding inhibition of human matriptase2 expressed in Drosophila melanogaster S2 cells using Boc-QAR-AMC as substrate incubated for 15 mins prio...


ACS Med Chem Lett 3: 530-534 (2012)


Article DOI: 10.1021/ml3000534
BindingDB Entry DOI: 10.7270/Q2DN469X
More data for this
Ligand-Target Pair
Matriptase


(Homo sapiens (Human))
BDBM236496
PNG
(US9365853, 7)
Show SMILES C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C31H47N13O8S/c1-15(40-27(51)19(10-11-22(33)45)42-26(50)16(32)6-4-12-38-30(34)35)25(49)43-20(14-23(46)47)28(52)41-18(8-5-13-39-31(36)37)24(48)29-44-17-7-2-3-9-21(17)53-29/h2-3,7,9,15-16,18-20H,4-6,8,10-14,32H2,1H3,(H2,33,45)(H,40,51)(H,41,52)(H,42,50)(H,43,49)(H,46,47)(H4,34,35,38)(H4,36,37,39)/t15-,16-,18+,19-,20-/m0/s1
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4.60n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Enzymatic assays were performed in the following reaction buffer: 50 mM HEPES, pH 7.4 containing 500 μg/ml bovine serum albumin. Enzyme activiti...


US Patent US9365853 (2016)


BindingDB Entry DOI: 10.7270/Q28W3C6F
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50032699
PNG
(CHEMBL3354677)
Show SMILES C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C31H43N11O5S/c1-17(26(45)40-22(8-5-15-38-31(35)36)25(44)29-42-21-7-2-3-9-24(21)48-29)39-28(47)23(16-18-10-12-19(43)13-11-18)41-27(46)20(32)6-4-14-37-30(33)34/h2-3,7,9-13,17,20,22-23,43H,4-6,8,14-16,32H2,1H3,(H,39,47)(H,40,45)(H,41,46)(H4,33,34,37)(H4,35,36,38)/t17-,20-,22-,23-/m0/s1
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6.30n/an/an/an/an/an/an/an/a



Universit£ de Sherbrooke

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matriptase-2 using Boc-Gln-Ala-Arg-AMC as substrate by microplate reader analysis


J Med Chem 57: 10198-204 (2014)


Article DOI: 10.1021/jm5015633
BindingDB Entry DOI: 10.7270/Q2DJ5H73
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50032696
PNG
(CHEMBL3354674)
Show SMILES N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C29H44N12O5S/c30-16(6-3-13-36-28(32)33)24(44)39-19(11-12-22(31)42)27(46)41-15-5-9-20(41)25(45)38-18(8-4-14-37-29(34)35)23(43)26-40-17-7-1-2-10-21(17)47-26/h1-2,7,10,16,18-20H,3-6,8-9,11-15,30H2,(H2,31,42)(H,38,45)(H,39,44)(H4,32,33,36)(H4,34,35,37)/t16-,18-,19-,20-/m0/s1
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7.80n/an/an/an/an/an/an/an/a



Universit£ de Sherbrooke

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matriptase-2 using Boc-Gln-Ala-Arg-AMC as substrate by microplate reader analysis


J Med Chem 57: 10198-204 (2014)


Article DOI: 10.1021/jm5015633
BindingDB Entry DOI: 10.7270/Q2DJ5H73
More data for this
Ligand-Target Pair
Matriptase


(Homo sapiens (Human))
BDBM236492
PNG
(US9365853, 3)
Show SMILES C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C27H42N10O5S/c1-15(34-25(42)19(11-12-21(30)38)36-24(41)16(29)7-6-14-33-27(31)32)23(40)35-18(9-4-5-13-28)22(39)26-37-17-8-2-3-10-20(17)43-26/h2-3,8,10,15-16,18-19H,4-7,9,11-14,28-29H2,1H3,(H2,30,38)(H,34,42)(H,35,40)(H,36,41)(H4,31,32,33)/t15-,16-,18-,19-/m0/s1
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9.5n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Enzymatic assays were performed in the following reaction buffer: 50 mM HEPES, pH 7.4 containing 500 μg/ml bovine serum albumin. Enzyme activiti...


US Patent US9365853 (2016)


BindingDB Entry DOI: 10.7270/Q28W3C6F
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50032701
PNG
(CHEMBL3354679)
Show SMILES CC(C)C[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C27H41N9O5S/c1-14(2)13-16(28)24(40)35-19(10-11-21(29)37)25(41)33-15(3)23(39)34-18(8-6-12-32-27(30)31)22(38)26-36-17-7-4-5-9-20(17)42-26/h4-5,7,9,14-16,18-19H,6,8,10-13,28H2,1-3H3,(H2,29,37)(H,33,41)(H,34,39)(H,35,40)(H4,30,31,32)/t15-,16-,18-,19-/m0/s1
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13n/an/an/an/an/an/an/an/a



Universit£ de Sherbrooke

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matriptase-2 using Boc-Gln-Ala-Arg-AMC as substrate by microplate reader analysis


J Med Chem 57: 10198-204 (2014)


Article DOI: 10.1021/jm5015633
BindingDB Entry DOI: 10.7270/Q2DJ5H73
More data for this
Ligand-Target Pair
Transmembrane protease serine 6


(Homo sapiens)
BDBM50032700
PNG
(CHEMBL3354678)
Show SMILES C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C28H46N14O4S/c1-15(39-24(46)19(10-6-14-38-28(34)35)41-23(45)16(29)7-4-12-36-26(30)31)22(44)40-18(9-5-13-37-27(32)33)21(43)25-42-17-8-2-3-11-20(17)47-25/h2-3,8,11,15-16,18-19H,4-7,9-10,12-14,29H2,1H3,(H,39,46)(H,40,44)(H,41,45)(H4,30,31,36)(H4,32,33,37)(H4,34,35,38)/t15-,16-,18-,19-/m0/s1
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15n/an/an/an/an/an/an/an/a



Universit£ de Sherbrooke

Curated by ChEMBL


Assay Description
Inhibition of human recombinant matriptase-2 using Boc-Gln-Ala-Arg-AMC as substrate by microplate reader analysis


J Med Chem 57: 10198-204 (2014)


Article DOI: 10.1021/jm5015633
BindingDB Entry DOI: 10.7270/Q2DJ5H73
More data for this
Ligand-Target Pair
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