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Compile Data Set for Download or QSAR

Found 31 hits Enz. Inhib. hit(s) with Target = 'Matrix metalloproteinase 17'   
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
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50062351
PNG
((R)-N*4*-Hydroxy-N*1*-[(S)-2-(1H-indol-3-yl)-1-met...)
Show SMILES CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NO
Show InChI InChI=1/C20H28N4O4/c1-12(2)8-13(10-18(25)24-28)19(26)23-17(20(27)21-3)9-14-11-22-16-7-5-4-6-15(14)16/h4-7,11-13,17,22,28H,8-10H2,1-3H3,(H,21,27)(H,23,26)(H,24,25)/t13-,17+/s2
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n/an/a 3.40n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of MMP17 catalytic domain


J Biol Chem 282: 27781-91 (2007)


Article DOI: 10.1074/jbc.M703286200
BindingDB Entry DOI: 10.7270/Q2Z89C58
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50035507
PNG
(CHEMBL3355722)
Show SMILES CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O
Show InChI InChI=1/C23H37N5O5/c1-15(2)12-17(14-20(29)28-33)22(31)27-19(13-16-8-4-3-5-9-16)23(32)26-18(21(25)30)10-6-7-11-24/h3-5,8-9,15,17-19,33H,6-7,10-14,24H2,1-2H3,(H2,25,30)(H,26,32)(H,27,31)(H,28,29)/t17-,18+,19+/s2
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n/an/a 5.70n/an/an/an/an/an/a



University Medical Center Groningen

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ADAM17 using Mca-PLAQAV-Dpa-RSSSR-NH2


Bioorg Med Chem 23: 192-202 (2014)


Article DOI: 10.1016/j.bmc.2014.11.013
BindingDB Entry DOI: 10.7270/Q26Q1ZVW
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50035475
PNG
(CHEMBL3355723)
Show SMILES CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCNC(=O)c1ccc(F)cc1)C(N)=O
Show InChI InChI=1/C30H40FN5O6/c1-19(2)16-22(18-26(37)36-42)29(40)35-25(17-20-8-4-3-5-9-20)30(41)34-24(27(32)38)10-6-7-15-33-28(39)21-11-13-23(31)14-12-21/h3-5,8-9,11-14,19,22,24-25,42H,6-7,10,15-18H2,1-2H3,(H2,32,38)(H,33,39)(H,34,41)(H,35,40)(H,36,37)/t22-,24+,25+/s2
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n/an/a 25n/an/an/an/an/an/a



University Medical Center Groningen

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ADAM17 using Mca-PLAQAV-Dpa-RSSSR-NH2


Bioorg Med Chem 23: 192-202 (2014)


Article DOI: 10.1016/j.bmc.2014.11.013
BindingDB Entry DOI: 10.7270/Q26Q1ZVW
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146471
PNG
(CHEMBL431226 | N-{1-(1,4-Dioxa-spiro[4.5]dec-8-yl)...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(C2CCC3(CC2)OCCO3)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C28H32N2O7S/c1-20-16-22(25-4-2-3-5-26(25)29-20)17-35-23-6-8-24(9-7-23)38(33,34)18-27(30(32)19-31)21-10-12-28(13-11-21)36-14-15-37-28/h2-9,16,19,21,27,32H,10-15,17-18H2,1H3
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n/an/a 220n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146480
PNG
(CHEMBL329967 | N-Hydroxy-N-{1-(4-hydroxyimino-cycl...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(CC2CCC(CC2)N=O)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C27H31N3O6S/c1-19-14-21(26-4-2-3-5-27(26)28-19)16-36-24-10-12-25(13-11-24)37(34,35)17-23(30(33)18-31)15-20-6-8-22(29-32)9-7-20/h2-5,10-14,18,20,22-23,33H,6-9,15-17H2,1H3
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n/an/a 330n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146467
PNG
(CHEMBL99365 | N-Hydroxy-N-[2-[4-(2-methyl-quinolin...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(CC2CCC(=O)CC2)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C27H30N2O6S/c1-19-14-21(26-4-2-3-5-27(26)28-19)16-35-24-10-12-25(13-11-24)36(33,34)17-22(29(32)18-30)15-20-6-8-23(31)9-7-20/h2-5,10-14,18,20,22,32H,6-9,15-17H2,1H3
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n/an/a 350n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146478
PNG
(CHEMBL98390 | N-Hydroxy-N-{1-(1-isobutyl-piperidin...)
Show SMILES CC(C)CN1CCC(CC(CS(=O)(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)N(O)C=O)CC1
Show InChI InChI=1/C30H39N3O5S/c1-22(2)18-32-14-12-24(13-15-32)17-26(33(35)21-34)20-39(36,37)28-10-8-27(9-11-28)38-19-25-16-23(3)31-30-7-5-4-6-29(25)30/h4-11,16,21-22,24,26,35H,12-15,17-20H2,1-3H3
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n/an/a 350n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146479
PNG
(CHEMBL328645 | N-Hydroxy-N-{1-(4-hydroxyimino-cycl...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(C2CCC(CC2)N=O)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C26H29N3O6S/c1-18-14-20(24-4-2-3-5-25(24)27-18)15-35-22-10-12-23(13-11-22)36(33,34)16-26(29(32)17-30)19-6-8-21(28-31)9-7-19/h2-5,10-14,17,19,21,26,32H,6-9,15-16H2,1H3
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n/an/a 500n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146473
PNG
(2,2-Dimethyl-propionic acid 4-{2-(formyl-hydroxy-a...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(C=C2CCN(CC2)OC(=O)C(C)(C)C)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C31H37N3O7S/c1-22-17-24(28-7-5-6-8-29(28)32-22)19-40-26-9-11-27(12-10-26)42(38,39)20-25(34(37)21-35)18-23-13-15-33(16-14-23)41-30(36)31(2,3)4/h5-12,17-18,21,25,37H,13-16,19-20H2,1-4H3
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n/an/a 550n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146469
PNG
(CHEMBL319782 | N-Hydroxy-N-[2-[4-(2-methyl-quinoli...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(C2CCC(=O)CC2)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C26H28N2O6S/c1-18-14-20(24-4-2-3-5-25(24)27-18)15-34-22-10-12-23(13-11-22)35(32,33)16-26(28(31)17-29)19-6-8-21(30)9-7-19/h2-5,10-14,17,19,26,31H,6-9,15-16H2,1H3
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n/an/a 600n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146474
PNG
(CHEMBL419896 | N-{2-(1,4-Dioxa-spiro[4.5]dec-8-yl)...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(CC2CCC3(CC2)OCCO3)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C29H34N2O7S/c1-21-16-23(27-4-2-3-5-28(27)30-21)18-36-25-6-8-26(9-7-25)39(34,35)19-24(31(33)20-32)17-22-10-12-29(13-11-22)37-14-15-38-29/h2-9,16,20,22,24,33H,10-15,17-19H2,1H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146470
PNG
(CHEMBL328199 | N-Hydroxy-N-{1-(4-methylene-cyclohe...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(C2CCC(=C)CC2)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C27H30N2O5S/c1-19-7-9-21(10-8-19)27(29(31)18-30)17-35(32,33)24-13-11-23(12-14-24)34-16-22-15-20(2)28-26-6-4-3-5-25(22)26/h3-6,11-15,18,21,27,31H,1,7-10,16-17H2,2H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146468
PNG
(CHEMBL98852 | N-Hydroxy-N-[2-[4-(2-methyl-quinolin...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(C=C2CCC(=O)CC2)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C27H28N2O6S/c1-19-14-21(26-4-2-3-5-27(26)28-19)16-35-24-10-12-25(13-11-24)36(33,34)17-22(29(32)18-30)15-20-6-8-23(31)9-7-20/h2-5,10-15,18,22,32H,6-9,16-17H2,1H3
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n/an/a 2.50E+3n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146477
PNG
(CHEMBL99045 | N-Hydroxy-N-[2-[4-(2-methyl-quinolin...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(C=C2CCOCC2)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C26H28N2O6S/c1-19-14-21(25-4-2-3-5-26(25)27-19)16-34-23-6-8-24(9-7-23)35(31,32)17-22(28(30)18-29)15-20-10-12-33-13-11-20/h2-9,14-15,18,22,30H,10-13,16-17H2,1H3
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n/an/a 3.00E+3n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146476
PNG
(CHEMBL99995 | N-Hydroxy-N-{1-(4-hydroxyimino-cyclo...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(C=C2CCC(CC2)N=O)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C27H29N3O6S/c1-19-14-21(26-4-2-3-5-27(26)28-19)16-36-24-10-12-25(13-11-24)37(34,35)17-23(30(33)18-31)15-20-6-8-22(29-32)9-7-20/h2-5,10-15,18,22-23,33H,6-9,16-17H2,1H3/b20-15-
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n/an/a 3.00E+3n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50035472
PNG
(CHEMBL3355724)
Show SMILES CC(C)C[C@H](CC(=O)NOC(=O)c1ccc(F)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCNC(=O)c1ccc(F)cc1)C(N)=O
Show InChI InChI=1/C37H43F2N5O7/c1-23(2)20-27(22-32(45)44-51-37(50)26-13-17-29(39)18-14-26)35(48)43-31(21-24-8-4-3-5-9-24)36(49)42-30(33(40)46)10-6-7-19-41-34(47)25-11-15-28(38)16-12-25/h3-5,8-9,11-18,23,27,30-31H,6-7,10,19-22H2,1-2H3,(H2,40,46)(H,41,47)(H,42,49)(H,43,48)(H,44,45)/t27-,30+,31+/s2
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n/an/a 3.26E+3n/an/an/an/an/an/a



University Medical Center Groningen

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ADAM17 using Mca-PLAQAV-Dpa-RSSSR-NH2


Bioorg Med Chem 23: 192-202 (2014)


Article DOI: 10.1016/j.bmc.2014.11.013
BindingDB Entry DOI: 10.7270/Q26Q1ZVW
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146472
PNG
(CHEMBL318252 | N-Hydroxy-N-{1-(1-isobutyl-piperidi...)
Show SMILES CC(C)CN1CCC(CC1)=CC(CS(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)N(O)C=O
Show InChI InChI=1/C30H37N3O5S/c1-22(2)18-32-14-12-24(13-15-32)17-26(33(35)21-34)20-39(36,37)28-10-8-27(9-11-28)38-19-25-16-23(3)31-30-7-5-4-6-29(25)30/h4-11,16-17,21-22,26,35H,12-15,18-20H2,1-3H3
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n/an/a 4.00E+3n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50146475
PNG
(CHEMBL98202 | N-Hydroxy-N-[2-[4-(2-methyl-quinolin...)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)CC(C=C2CCSCC2)N(O)C=O)c2ccccc2n1
Show InChI InChI=1/C26H28N2O5S2/c1-19-14-21(25-4-2-3-5-26(25)27-19)16-33-23-6-8-24(9-7-23)35(31,32)17-22(28(30)18-29)15-20-10-12-34-13-11-20/h2-9,14-15,18,22,30H,10-13,16-17H2,1H3
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n/an/a 4.00E+3n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase-17


Bioorg Med Chem Lett 14: 2897-900 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.048
BindingDB Entry DOI: 10.7270/Q27S7N7C
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM400682
PNG
(US10000476, Compound I-41)
Show SMILES Cc1cccn(CC2(NC(=O)NC2=O)c2ccc(Cc3ccc(F)cc3)cc2)c1=O
Show InChI InChI=1S/C23H20FN3O3/c1-15-3-2-12-27(20(15)28)14-23(21(29)25-22(30)26-23)18-8-4-16(5-9-18)13-17-6-10-19(24)11-7-17/h2-12H,13-14H2,1H3,(H2,25,26,29,30)
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n/an/a 1.60E+4n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

US Patent


Assay Description
MMP-17: 90 μL (5.8 ng) of human MMP-17 (Calbiochem #475940) prepared with an assay buffer A was added to 90 μL of a 20 μM fluorescent ...


US Patent US10000476 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM400650
PNG
(US10000476, Compound I-9)
Show SMILES Cc1cccn(CC2(NC(=O)NC2=O)c2ccc(Oc3ccccc3)cc2)c1=O
Show InChI InChI=1S/C22H19N3O4/c1-15-6-5-13-25(19(15)26)14-22(20(27)23-21(28)24-22)16-9-11-18(12-10-16)29-17-7-3-2-4-8-17/h2-13H,14H2,1H3,(H2,23,24,27,28)
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n/an/a 2.10E+4n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

US Patent


Assay Description
MMP-17: 90 μL (5.8 ng) of human MMP-17 (Calbiochem #475940) prepared with an assay buffer A was added to 90 μL of a 20 μM fluorescent ...


US Patent US10000476 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM400727
PNG
(US10000476, Compound I-86)
Show SMILES Cc1cccn(CC2(NC(=O)NC2=O)c2ccc(Oc3ccccc3F)cc2)c1=O
Show InChI InChI=1S/C22H18FN3O4/c1-14-5-4-12-26(19(14)27)13-22(20(28)24-21(29)25-22)15-8-10-16(11-9-15)30-18-7-3-2-6-17(18)23/h2-12H,13H2,1H3,(H2,24,25,28,29)
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n/an/a 2.70E+4n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

US Patent


Assay Description
MMP-17: 90 μL (5.8 ng) of human MMP-17 (Calbiochem #475940) prepared with an assay buffer A was added to 90 μL of a 20 μM fluorescent ...


US Patent US10000476 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50265079
PNG
((4-[1-methyl-2,4-dioxo-6-(3-phenyl-prop-1-ynyl)-1,...)
Show SMILES Cn1c2ccc(cc2c(=O)n(Cc2ccc(cc2)C(O)=O)c1=O)C#CCc1ccccc1
Show InChI InChI=1S/C26H20N2O4/c1-27-23-15-12-19(9-5-8-18-6-3-2-4-7-18)16-22(23)24(29)28(26(27)32)17-20-10-13-21(14-11-20)25(30)31/h2-4,6-7,10-16H,8,17H2,1H3,(H,30,31)
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Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of MMP17 catalytic domain


J Biol Chem 282: 27781-91 (2007)


Article DOI: 10.1074/jbc.M703286200
BindingDB Entry DOI: 10.7270/Q2Z89C58
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50234334
PNG
(BENZYL 6-BENZYL-5,7-DIOXO-6,7-DIHYDRO-5H-[1,3]THIA...)
Show SMILES O=C(OCc1ccccc1)c1cn2c(cc(=O)n(Cc3ccccc3)c2=O)s1
Show InChI InChI=1S/C21H16N2O4S/c24-18-11-19-23(21(26)22(18)12-15-7-3-1-4-8-15)13-17(28-19)20(25)27-14-16-9-5-2-6-10-16/h1-11,13H,12,14H2
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Universidad CEU San Pablo

Curated by ChEMBL


Assay Description
Inhibition of MMP17 (unknown origin)


J Med Chem 57: 10205-19 (2014)


Article DOI: 10.1021/jm500505f
BindingDB Entry DOI: 10.7270/Q2NK3GMC
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50265079
PNG
((4-[1-methyl-2,4-dioxo-6-(3-phenyl-prop-1-ynyl)-1,...)
Show SMILES Cn1c2ccc(cc2c(=O)n(Cc2ccc(cc2)C(O)=O)c1=O)C#CCc1ccccc1
Show InChI InChI=1S/C26H20N2O4/c1-27-23-15-12-19(9-5-8-18-6-3-2-4-7-18)16-22(23)24(29)28(26(27)32)17-20-10-13-21(14-11-20)25(30)31/h2-4,6-7,10-16H,8,17H2,1H3,(H,30,31)
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Universidad CEU San Pablo

Curated by ChEMBL


Assay Description
Inhibition of MMP17 (unknown origin)


J Med Chem 57: 10205-19 (2014)


Article DOI: 10.1021/jm500505f
BindingDB Entry DOI: 10.7270/Q2NK3GMC
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM400681
PNG
(US10000476, Compound I-40)
Show SMILES Cc1cccn(CC2(NC(=O)NC2=O)c2ccc(Cc3ccccc3)cc2)c1=O
Show InChI InChI=1S/C23H21N3O3/c1-16-6-5-13-26(20(16)27)15-23(21(28)24-22(29)25-23)19-11-9-18(10-12-19)14-17-7-3-2-4-8-17/h2-13H,14-15H2,1H3,(H2,24,25,28,29)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

US Patent


Assay Description
MMP-17: 90 μL (5.8 ng) of human MMP-17 (Calbiochem #475940) prepared with an assay buffer A was added to 90 μL of a 20 μM fluorescent ...


US Patent US10000476 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM400703
PNG
(US10000476, Compound I-62)
Show SMILES Cc1cccn(CC2(NC(=O)NC2=O)c2cccc(c2)-c2cccnc2)c1=O
Show InChI InChI=1S/C21H18N4O3/c1-14-5-4-10-25(18(14)26)13-21(19(27)23-20(28)24-21)17-8-2-6-15(11-17)16-7-3-9-22-12-16/h2-12H,13H2,1H3,(H2,23,24,27,28)
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n/an/a 4.50E+4n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

US Patent


Assay Description
MMP-17: 90 μL (5.8 ng) of human MMP-17 (Calbiochem #475940) prepared with an assay buffer A was added to 90 μL of a 20 μM fluorescent ...


US Patent US10000476 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM400668
PNG
(US10000476, Compound I-27)
Show SMILES COc1ccc(Cl)cc1C1(Cn2cccc(C)c2=O)NC(=O)NC1=O
Show InChI InChI=1S/C17H16ClN3O4/c1-10-4-3-7-21(14(10)22)9-17(15(23)19-16(24)20-17)12-8-11(18)5-6-13(12)25-2/h3-8H,9H2,1-2H3,(H2,19,20,23,24)
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n/an/a 5.70E+4n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

US Patent


Assay Description
MMP-17: 90 μL (5.8 ng) of human MMP-17 (Calbiochem #475940) prepared with an assay buffer A was added to 90 μL of a 20 μM fluorescent ...


US Patent US10000476 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM400699
PNG
(US10000476, Compound I-58 | US10000476, Compound I...)
Show SMILES Cc1cccn(CC2(NC(=O)NC2=O)c2cccc(OCc3ccccc3)c2)c1=O
Show InChI InChI=1S/C23H21N3O4/c1-16-7-6-12-26(20(16)27)15-23(21(28)24-22(29)25-23)18-10-5-11-19(13-18)30-14-17-8-3-2-4-9-17/h2-13H,14-15H2,1H3,(H2,24,25,28,29)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Kaken Pharmaceutical Co., Ltd

US Patent


Assay Description
MMP-17: 90 μL (5.8 ng) of human MMP-17 (Calbiochem #475940) prepared with an assay buffer A was added to 90 μL of a 20 μM fluorescent ...


US Patent US10000476 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM50234334
PNG
(BENZYL 6-BENZYL-5,7-DIOXO-6,7-DIHYDRO-5H-[1,3]THIA...)
Show SMILES O=C(OCc1ccccc1)c1cn2c(cc(=O)n(Cc3ccccc3)c2=O)s1
Show InChI InChI=1S/C21H16N2O4S/c24-18-11-19-23(21(26)22(18)12-15-7-3-1-4-8-15)13-17(28-19)20(25)27-14-16-9-5-2-6-10-16/h1-11,13H,12,14H2
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Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of MMP17 catalytic domain


J Biol Chem 282: 27781-91 (2007)


Article DOI: 10.1074/jbc.M703286200
BindingDB Entry DOI: 10.7270/Q2Z89C58
More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM400651
PNG
(US10000476, Compound I-10 | US10000476, Compound I...)
Show SMILES Cc1cccn(CC2(NC(=O)NC2=O)c2ccc(F)c(F)c2)c1=O
Show InChI InChI=1S/C16H13F2N3O3/c1-9-3-2-6-21(13(9)22)8-16(14(23)19-15(24)20-16)10-4-5-11(17)12(18)7-10/h2-7H,8H2,1H3,(H2,19,20,23,24)
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Kaken Pharmaceutical Co., Ltd

US Patent


Assay Description
MMP-17: 90 μL (5.8 ng) of human MMP-17 (Calbiochem #475940) prepared with an assay buffer A was added to 90 μL of a 20 μM fluorescent ...


US Patent US10000476 (2018)

More data for this
Ligand-Target Pair
Matrix metalloproteinase 17


(Homo sapiens (Human))
BDBM400231
PNG
(US10000476, Compound I-1 | US10000476, Compound I-...)
Show SMILES Cc1cccn(CC2(NC(=O)NC2=O)c2ccncc2)c1=O
Show InChI InChI=1S/C15H14N4O3/c1-10-3-2-8-19(12(10)20)9-15(11-4-6-16-7-5-11)13(21)17-14(22)18-15/h2-8H,9H2,1H3,(H2,17,18,21,22)
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Kaken Pharmaceutical Co., Ltd

US Patent


Assay Description
MMP-17: 90 μL (5.8 ng) of human MMP-17 (Calbiochem #475940) prepared with an assay buffer A was added to 90 μL of a 20 μM fluorescent ...


US Patent US10000476 (2018)

More data for this
Ligand-Target Pair