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Compile Data Set for Download or QSAR

Found 105 hits of ki for UniProtKB: P50281   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120258
PNG
(US8691753, 95 bis)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](CC(O)=O)Cc1ccc(cc1)-c1cc(cs1)-c1ccccc1 |r|
Show InChI InChI=1S/C31H33N3O9S/c32-29(41)23(10-12-26(35)36)33-31(43)24(11-13-27(37)38)34-30(42)21(16-28(39)40)14-18-6-8-20(9-7-18)25-15-22(17-44-25)19-4-2-1-3-5-19/h1-9,15,17,21,23-24H,10-14,16H2,(H2,32,41)(H,33,43)(H,34,42)(H,35,36)(H,37,38)(H,39,40)/t21-,23+,24+/m1/s1
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118n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120190
PNG
(US8691753, 38)
Show SMILES CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccsc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|
Show InChI InChI=1S/C22H27N3O5S/c1-2-17(22(30)25-18(21(23)29)8-10-20(27)28)24-19(26)9-5-14-3-6-15(7-4-14)16-11-12-31-13-16/h3-4,6-7,11-13,17-18H,2,5,8-10H2,1H3,(H2,23,29)(H,24,26)(H,25,30)(H,27,28)/t17-,18-/m0/s1
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410n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120241
PNG
(US8691753, 90)
Show SMILES OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1cccs1)C(=O)Nc1cccc(CC(O)=O)c1 |r|
Show InChI InChI=1S/C26H26N2O6S/c29-23(12-8-17-6-9-19(10-7-17)22-5-2-14-35-22)28-21(11-13-24(30)31)26(34)27-20-4-1-3-18(15-20)16-25(32)33/h1-7,9-10,14-15,21H,8,11-13,16H2,(H,27,34)(H,28,29)(H,30,31)(H,32,33)/t21-/m0/s1
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430n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120187
PNG
(US8691753, 35)
Show SMILES CC[C@H](NC(=O)CCc1ccc(cc1)-c1csnn1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|
Show InChI InChI=1S/C20H25N5O5S/c1-2-14(20(30)23-15(19(21)29)8-10-18(27)28)22-17(26)9-5-12-3-6-13(7-4-12)16-11-31-25-24-16/h3-4,6-7,11,14-15H,2,5,8-10H2,1H3,(H2,21,29)(H,22,26)(H,23,30)(H,27,28)/t14-,15-/m0/s1
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438n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120191
PNG
(US8691753, 39)
Show SMILES CC[C@H](NC(=O)CCc1ccc(cc1)-c1nc2ccccc2s1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|
Show InChI InChI=1S/C25H28N4O5S/c1-2-17(24(34)28-19(23(26)33)12-14-22(31)32)27-21(30)13-9-15-7-10-16(11-8-15)25-29-18-5-3-4-6-20(18)35-25/h3-8,10-11,17,19H,2,9,12-14H2,1H3,(H2,26,33)(H,27,30)(H,28,34)(H,31,32)/t17-,19-/m0/s1
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547n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120165
PNG
(US8691753, 13)
Show SMILES NC(=O)[C@H](CCCC(O)=O)NC(=O)[C@H](CCCOC=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C30H33ClN4O8/c31-22-5-1-4-21(16-22)19-9-11-20(12-10-19)26-17-23(43-35-26)13-14-27(37)33-25(7-3-15-42-18-36)30(41)34-24(29(32)40)6-2-8-28(38)39/h1,4-5,9-12,16-18,24-25H,2-3,6-8,13-15H2,(H2,32,40)(H,33,37)(H,34,41)(H,38,39)/t24-,25-/m0/s1
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553n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120222
PNG
(US8691753, 71)
Show SMILES OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(=O)Nc1cccc(CC(O)=O)c1 |r|
Show InChI InChI=1S/C34H32N2O6/c37-31(36-30(18-20-32(38)39)34(42)35-29-8-4-5-24(21-29)22-33(40)41)19-11-23-9-12-26(13-10-23)28-16-14-27(15-17-28)25-6-2-1-3-7-25/h1-10,12-17,21,30H,11,18-20,22H2,(H,35,42)(H,36,37)(H,38,39)(H,40,41)/t30-/m0/s1
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696n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120155
PNG
(US8691753, 3)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C28H29ClN4O8/c29-19-3-1-2-18(14-19)16-4-6-17(7-5-16)23-15-20(41-33-23)8-11-24(34)31-22(10-13-26(37)38)28(40)32-21(27(30)39)9-12-25(35)36/h1-7,14-15,21-22H,8-13H2,(H2,30,39)(H,31,34)(H,32,40)(H,35,36)(H,37,38)/t21-,22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120156
PNG
(US8691753, 4)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C23H22ClN3O5/c24-17-3-1-2-16(12-17)14-4-6-15(7-5-14)20-13-18(32-27-20)8-10-21(28)26-19(23(25)31)9-11-22(29)30/h1-7,12-13,19H,8-11H2,(H2,25,31)(H,26,28)(H,29,30)/t19-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120157
PNG
(US8691753, 5)
Show SMILES NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C28H29ClN4O8/c29-19-3-1-2-18(14-19)16-4-6-17(7-5-16)23-15-20(41-33-23)8-11-24(34)31-22(10-13-26(37)38)28(40)32-21(27(30)39)9-12-25(35)36/h1-7,14-15,21-22H,8-13H2,(H2,30,39)(H,31,34)(H,32,40)(H,35,36)(H,37,38)/t21-,22+/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120160
PNG
(US8691753, 8)
Show SMILES NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C27H27ClN4O8/c28-18-3-1-2-17(12-18)15-4-6-16(7-5-15)21-13-19(40-32-21)8-10-23(33)30-20(9-11-24(34)35)27(39)31-22(26(29)38)14-25(36)37/h1-7,12-13,20,22H,8-11,14H2,(H2,29,38)(H,30,33)(H,31,39)(H,34,35)(H,36,37)/t20-,22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120162
PNG
(US8691753, 10)
Show SMILES NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C26H25ClN4O8/c27-17-3-1-2-16(10-17)14-4-6-15(7-5-14)19-11-18(39-31-19)8-9-22(32)29-21(13-24(35)36)26(38)30-20(25(28)37)12-23(33)34/h1-7,10-11,20-21H,8-9,12-13H2,(H2,28,37)(H,29,32)(H,30,38)(H,33,34)(H,35,36)/t20-,21-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120166
PNG
(US8691753, 14)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccccc1 |r|
Show InChI InChI=1S/C22H26N4O8/c23-21(32)15(7-10-19(28)29)25-22(33)16(8-11-20(30)31)24-18(27)9-6-14-12-17(26-34-14)13-4-2-1-3-5-13/h1-5,12,15-16H,6-11H2,(H2,23,32)(H,24,27)(H,25,33)(H,28,29)(H,30,31)/t15-,16-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120167
PNG
(US8691753, 15)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccccc1 |r|
Show InChI InChI=1S/C17H19N3O5/c18-17(24)13(7-9-16(22)23)19-15(21)8-6-12-10-14(20-25-12)11-4-2-1-3-5-11/h1-5,10,13H,6-9H2,(H2,18,24)(H,19,21)(H,22,23)/t13-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120168
PNG
(US8691753, 16)
Show SMILES CC[C@H](NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|
Show InChI InChI=1S/C27H30N4O6/c1-2-21(27(36)30-22(26(28)35)13-15-25(33)34)29-24(32)14-12-20-16-23(31-37-20)19-10-8-18(9-11-19)17-6-4-3-5-7-17/h3-11,16,21-22H,2,12-15H2,1H3,(H2,28,35)(H,29,32)(H,30,36)(H,33,34)/t21-,22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120170
PNG
(US8691753, 18)
Show SMILES CC[C@H](NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CC(O)=O)C(N)=O |r|
Show InChI InChI=1S/C26H28N4O6/c1-2-20(26(35)29-22(25(27)34)15-24(32)33)28-23(31)13-12-19-14-21(30-36-19)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,14,20,22H,2,12-13,15H2,1H3,(H2,27,34)(H,28,31)(H,29,35)(H,32,33)/t20-,22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120171
PNG
(US8691753, 19)
Show SMILES NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C26H26N4O8/c27-25(36)20(13-23(32)33)29-26(37)21(14-24(34)35)28-22(31)11-10-18-12-19(30-38-18)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-9,12,20-21H,10-11,13-14H2,(H2,27,36)(H,28,31)(H,29,37)(H,32,33)(H,34,35)/t20-,21-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120173
PNG
(US8691753, 21)
Show SMILES NC(=O)CC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C28H31N5O7/c29-24(34)13-11-21(27(30)38)32-28(39)22(12-15-26(36)37)31-25(35)14-10-20-16-23(33-40-20)19-8-6-18(7-9-19)17-4-2-1-3-5-17/h1-9,16,21-22H,10-15H2,(H2,29,34)(H2,30,38)(H,31,35)(H,32,39)(H,36,37)/t21-,22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120175
PNG
(US8691753, 23)
Show SMILES C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(no1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C26H28N4O6/c1-16(25(27)34)28-26(35)21(12-14-24(32)33)29-23(31)13-11-20-15-22(30-36-20)19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,15-16,21H,11-14H2,1H3,(H2,27,34)(H,28,35)(H,29,31)(H,32,33)/t16-,21-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120177
PNG
(US8691753, 25)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1cc(on1)-c1ccccc1 |r|
Show InChI InChI=1S/C22H26N4O8/c23-21(32)15(7-10-19(28)29)25-22(33)16(8-11-20(30)31)24-18(27)9-6-14-12-17(34-26-14)13-4-2-1-3-5-13/h1-5,12,15-16H,6-11H2,(H2,23,32)(H,24,27)(H,25,33)(H,28,29)(H,30,31)/t15-,16-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120180
PNG
(US8691753, 28)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(Oc2ccccc2)cc1 |r|
Show InChI InChI=1S/C25H29N3O8/c26-24(34)19(11-14-22(30)31)28-25(35)20(12-15-23(32)33)27-21(29)13-8-16-6-9-18(10-7-16)36-17-4-2-1-3-5-17/h1-7,9-10,19-20H,8,11-15H2,(H2,26,34)(H,27,29)(H,28,35)(H,30,31)(H,32,33)/t19-,20-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120182
PNG
(US8691753, 30)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)C#Cc1ccccc1 |r|
Show InChI InChI=1S/C27H29N3O7/c28-26(36)21(13-16-24(32)33)30-27(37)22(14-17-25(34)35)29-23(31)15-12-20-10-8-19(9-11-20)7-6-18-4-2-1-3-5-18/h1-5,8-11,21-22H,12-17H2,(H2,28,36)(H,29,31)(H,30,37)(H,32,33)(H,34,35)/t21-,22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120183
PNG
(US8691753, 31)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(I)cc1 |r|
Show InChI InChI=1S/C19H24IN3O7/c20-12-4-1-11(2-5-12)3-8-15(24)22-14(7-10-17(27)28)19(30)23-13(18(21)29)6-9-16(25)26/h1-2,4-5,13-14H,3,6-10H2,(H2,21,29)(H,22,24)(H,23,30)(H,25,26)(H,27,28)/t13-,14-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120184
PNG
(US8691753, 32)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ncccn1 |r|
Show InChI InChI=1S/C23H27N5O7/c24-21(34)16(7-10-19(30)31)28-23(35)17(8-11-20(32)33)27-18(29)9-4-14-2-5-15(6-3-14)22-25-12-1-13-26-22/h1-3,5-6,12-13,16-17H,4,7-11H2,(H2,24,34)(H,27,29)(H,28,35)(H,30,31)(H,32,33)/t16-,17-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120185
PNG
(US8691753, 33)
Show SMILES Cn1ccc(n1)-c1ccc(CCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(N)=O)cc1 |r|
Show InChI InChI=1S/C23H29N5O7/c1-28-13-12-16(27-28)15-5-2-14(3-6-15)4-9-19(29)25-18(8-11-21(32)33)23(35)26-17(22(24)34)7-10-20(30)31/h2-3,5-6,12-13,17-18H,4,7-11H2,1H3,(H2,24,34)(H,25,29)(H,26,35)(H,30,31)(H,32,33)/t17-,18-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120186
PNG
(US8691753, 34)
Show SMILES Cc1nc(no1)-c1ccc(CCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(N)=O)cc1 |r|
Show InChI InChI=1S/C22H27N5O8/c1-12-24-21(27-35-12)14-5-2-13(3-6-14)4-9-17(28)25-16(8-11-19(31)32)22(34)26-15(20(23)33)7-10-18(29)30/h2-3,5-6,15-16H,4,7-11H2,1H3,(H2,23,33)(H,25,28)(H,26,34)(H,29,30)(H,31,32)/t15-,16-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120189
PNG
(US8691753, 37)
Show SMILES CC[C@H](NC(=O)CCc1ccc(cc1)-c1nccs1)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|
Show InChI InChI=1S/C21H26N4O5S/c1-2-15(20(30)25-16(19(22)29)8-10-18(27)28)24-17(26)9-5-13-3-6-14(7-4-13)21-23-11-12-31-21/h3-4,6-7,11-12,15-16H,2,5,8-10H2,1H3,(H2,22,29)(H,24,26)(H,25,30)(H,27,28)/t15-,16-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120193
PNG
(US8691753, 42)
Show SMILES CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(N)=O |r|
Show InChI InChI=1S/C24H30N4O4/c1-2-19(24(32)28-20(23(26)31)13-14-21(25)29)27-22(30)15-10-16-8-11-18(12-9-16)17-6-4-3-5-7-17/h3-9,11-12,19-20H,2,10,13-15H2,1H3,(H2,25,29)(H2,26,31)(H,27,30)(H,28,32)/t19-,20-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120200
PNG
(US8691753, 49)
Show SMILES NC(=O)[C@H](CO)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C23H27N3O6/c24-22(31)19(14-27)26-23(32)18(11-13-21(29)30)25-20(28)12-8-15-6-9-17(10-7-15)16-4-2-1-3-5-16/h1-7,9-10,18-19,27H,8,11-14H2,(H2,24,31)(H,25,28)(H,26,32)(H,29,30)/t18-,19-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120203
PNG
(US8691753, 52)
Show SMILES OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccccc1)C(=O)Nc1cccc(CC(O)=O)c1 |r|
Show InChI InChI=1S/C28H28N2O6/c31-25(15-11-19-9-12-22(13-10-19)21-6-2-1-3-7-21)30-24(14-16-26(32)33)28(36)29-23-8-4-5-20(17-23)18-27(34)35/h1-10,12-13,17,24H,11,14-16,18H2,(H,29,36)(H,30,31)(H,32,33)(H,34,35)/t24-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120204
PNG
(US8691753, 53)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccc(N)c1 |r|
Show InChI InChI=1S/C25H30N4O7/c26-18-3-1-2-17(14-18)16-7-4-15(5-8-16)6-11-21(30)28-20(10-13-23(33)34)25(36)29-19(24(27)35)9-12-22(31)32/h1-5,7-8,14,19-20H,6,9-13,26H2,(H2,27,35)(H,28,30)(H,29,36)(H,31,32)(H,33,34)/t19-,20-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120209
PNG
(US8691753, 58)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cc(Cl)cc(Cl)c1 |r|
Show InChI InChI=1S/C25H27Cl2N3O7/c26-17-11-16(12-18(27)13-17)15-4-1-14(2-5-15)3-8-21(31)29-20(7-10-23(34)35)25(37)30-19(24(28)36)6-9-22(32)33/h1-2,4-5,11-13,19-20H,3,6-10H2,(H2,28,36)(H,29,31)(H,30,37)(H,32,33)(H,34,35)/t19-,20-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120212
PNG
(US8691753, 61 | US8691753, 72)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C31H33N3O7/c32-30(40)25(15-18-28(36)37)34-31(41)26(16-19-29(38)39)33-27(35)17-8-20-6-9-22(10-7-20)24-13-11-23(12-14-24)21-4-2-1-3-5-21/h1-7,9-14,25-26H,8,15-19H2,(H2,32,40)(H,33,35)(H,34,41)(H,36,37)(H,38,39)/t25-,26-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120213
PNG
(US8691753, 62)
Show SMILES NC(=O)CC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C31H34N4O6/c32-27(36)17-15-25(30(33)40)35-31(41)26(16-19-29(38)39)34-28(37)18-8-20-6-9-22(10-7-20)24-13-11-23(12-14-24)21-4-2-1-3-5-21/h1-7,9-14,25-26H,8,15-19H2,(H2,32,36)(H2,33,40)(H,34,37)(H,35,41)(H,38,39)/t25-,26-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120214
PNG
(US8691753, 63)
Show SMILES NCCCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C32H38N4O5/c33-21-5-4-8-27(31(34)40)36-32(41)28(18-20-30(38)39)35-29(37)19-11-22-9-12-24(13-10-22)26-16-14-25(15-17-26)23-6-2-1-3-7-23/h1-3,6-7,9-10,12-17,27-28H,4-5,8,11,18-21,33H2,(H2,34,40)(H,35,37)(H,36,41)(H,38,39)/t27-,28-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120216
PNG
(US8691753, 65)
Show SMILES NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C35H35N3O6/c36-34(43)31(22-24-8-17-29(39)18-9-24)38-35(44)30(19-21-33(41)42)37-32(40)20-10-23-6-11-26(12-7-23)28-15-13-27(14-16-28)25-4-2-1-3-5-25/h1-9,11-18,30-31,39H,10,19-22H2,(H2,36,43)(H,37,40)(H,38,44)(H,41,42)/t30-,31-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120218
PNG
(US8691753, 67)
Show SMILES NC(=O)C(Cc1cnc[nH]1)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C32H33N5O5/c33-31(41)28(18-26-19-34-20-35-26)37-32(42)27(15-17-30(39)40)36-29(38)16-8-21-6-9-23(10-7-21)25-13-11-24(12-14-25)22-4-2-1-3-5-22/h1-7,9-14,19-20,27-28H,8,15-18H2,(H2,33,41)(H,34,35)(H,36,38)(H,37,42)(H,39,40)/t27-,28?/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120219
PNG
(US8691753, 68)
Show SMILES NC(=O)[C@H](CO)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C29H31N3O6/c30-28(37)25(18-33)32-29(38)24(15-17-27(35)36)31-26(34)16-8-19-6-9-21(10-7-19)23-13-11-22(12-14-23)20-4-2-1-3-5-20/h1-7,9-14,24-25,33H,8,15-18H2,(H2,30,37)(H,31,34)(H,32,38)(H,35,36)/t24-,25-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120221
PNG
(US8691753, 70)
Show SMILES OC(=O)CC[C@H](NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1)C(=O)N1CCCC(CC(O)=O)C1 |r|
Show InChI InChI=1S/C33H36N2O6/c36-30(34-29(17-19-31(37)38)33(41)35-20-4-5-24(22-35)21-32(39)40)18-10-23-8-11-26(12-9-23)28-15-13-27(14-16-28)25-6-2-1-3-7-25/h1-3,6-9,11-16,24,29H,4-5,10,17-22H2,(H,34,36)(H,37,38)(H,39,40)/t24?,29-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120225
PNG
(US8691753, 74)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C30H31N3O7/c31-29(39)24(15-17-27(35)36)33-30(40)25(18-28(37)38)32-26(34)16-8-19-6-9-21(10-7-19)23-13-11-22(12-14-23)20-4-2-1-3-5-20/h1-7,9-14,24-25H,8,15-18H2,(H2,31,39)(H,32,34)(H,33,40)(H,35,36)(H,37,38)/t24-,25-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120229
PNG
(US8691753, 78)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C29H31N3O6/c30-28(37)24(15-17-27(35)36)32-29(38)25(18-33)31-26(34)16-8-19-6-9-21(10-7-19)23-13-11-22(12-14-23)20-4-2-1-3-5-20/h1-7,9-14,24-25,33H,8,15-18H2,(H2,30,37)(H,31,34)(H,32,38)(H,35,36)/t24-,25-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120231
PNG
(US8691753, 80)
Show SMILES NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1 |r|
Show InChI InChI=1S/C23H27N3O7S/c24-22(32)16(8-11-20(28)29)26-23(33)17(9-12-21(30)31)25-19(27)10-5-14-3-6-15(7-4-14)18-2-1-13-34-18/h1-4,6-7,13,16-17H,5,8-12H2,(H2,24,32)(H,25,27)(H,26,33)(H,28,29)(H,30,31)/t16-,17-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120232
PNG
(US8691753, 81)
Show SMILES NC(=O)CC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1)C(N)=O |r|
Show InChI InChI=1S/C23H28N4O6S/c24-19(28)10-8-16(22(25)32)27-23(33)17(9-12-21(30)31)26-20(29)11-5-14-3-6-15(7-4-14)18-2-1-13-34-18/h1-4,6-7,13,16-17H,5,8-12H2,(H2,24,28)(H2,25,32)(H,26,29)(H,27,33)(H,30,31)/t16-,17-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120233
PNG
(US8691753, 82)
Show SMILES NCCCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1)C(N)=O |r|
Show InChI InChI=1S/C24H32N4O5S/c25-14-2-1-4-18(23(26)32)28-24(33)19(11-13-22(30)31)27-21(29)12-8-16-6-9-17(10-7-16)20-5-3-15-34-20/h3,5-7,9-10,15,18-19H,1-2,4,8,11-14,25H2,(H2,26,32)(H,27,29)(H,28,33)(H,30,31)/t18-,19-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120234
PNG
(US8691753, 83)
Show SMILES NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1 |r|
Show InChI InChI=1S/C22H25N3O7S/c23-21(31)16(12-20(29)30)25-22(32)15(8-10-19(27)28)24-18(26)9-5-13-3-6-14(7-4-13)17-2-1-11-33-17/h1-4,6-7,11,15-16H,5,8-10,12H2,(H2,23,31)(H,24,26)(H,25,32)(H,27,28)(H,29,30)/t15-,16-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120235
PNG
(US8691753, 84)
Show SMILES NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1 |r|
Show InChI InChI=1S/C27H29N3O6S/c28-26(35)22(16-18-5-10-20(31)11-6-18)30-27(36)21(12-14-25(33)34)29-24(32)13-7-17-3-8-19(9-4-17)23-2-1-15-37-23/h1-6,8-11,15,21-22,31H,7,12-14,16H2,(H2,28,35)(H,29,32)(H,30,36)(H,33,34)/t21-,22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120236
PNG
(US8691753, 85)
Show SMILES C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1)C(N)=O |r|
Show InChI InChI=1S/C21H25N3O5S/c1-13(20(22)28)23-21(29)16(9-11-19(26)27)24-18(25)10-6-14-4-7-15(8-5-14)17-3-2-12-30-17/h2-5,7-8,12-13,16H,6,9-11H2,1H3,(H2,22,28)(H,23,29)(H,24,25)(H,26,27)/t13-,16-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120237
PNG
(US8691753, 86)
Show SMILES NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1 |r|
Show InChI InChI=1S/C24H27N5O5S/c25-23(33)19(12-17-13-26-14-27-17)29-24(34)18(8-10-22(31)32)28-21(30)9-5-15-3-6-16(7-4-15)20-2-1-11-35-20/h1-4,6-7,11,13-14,18-19H,5,8-10,12H2,(H2,25,33)(H,26,27)(H,28,30)(H,29,34)(H,31,32)/t18-,19-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120238
PNG
(US8691753, 87)
Show SMILES NC(=O)[C@H](CO)NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1 |r|
Show InChI InChI=1S/C21H25N3O6S/c22-20(29)16(12-25)24-21(30)15(8-10-19(27)28)23-18(26)9-5-13-3-6-14(7-4-13)17-2-1-11-31-17/h1-4,6-7,11,15-16,25H,5,8-10,12H2,(H2,22,29)(H,23,26)(H,24,30)(H,27,28)/t15-,16-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
Matrix metalloproteinase-14 [1-20,P8S]


(Homo sapiens (Human))
BDBM120239
PNG
(US8691753, 88)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)CCc1ccc(cc1)-c1cccs1)C(N)=O |r|
Show InChI InChI=1S/C24H31N3O5S/c1-15(2)14-19(23(25)31)27-24(32)18(10-12-22(29)30)26-21(28)11-7-16-5-8-17(9-6-16)20-4-3-13-33-20/h3-6,8-9,13,15,18-19H,7,10-12,14H2,1-2H3,(H2,25,31)(H,26,28)(H,27,32)(H,29,30)/t18-,19-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Commissariat A l'Energie Atomique et Aux Energies Alternatives

US Patent


Assay Description
The inhibition tests and the evaluation of the inhibition constants (Ki) on the various MMPs were carried out as described by Devel et al. (Devel et ...


US Patent US8691753 (2014)


BindingDB Entry DOI: 10.7270/Q28P5Z5Q
More data for this
Ligand-Target Pair
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