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Compile Data Set for Download or QSAR

Found 10 hits of ph data with Target = 'Matrix metalloproteinase-2 (MMP-2)'   
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-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199119
PNG
(N-(4-(1-(4,6-bis(methylamino)-1,3,5-triazin-2-yl)-...)
Show SMILES CNc1nc(NC)nc(n1)-n1nc(cc1-c1ccc(OC)cc1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C28H28N8O3S/c1-18-5-15-23(16-6-18)40-39-38-35-21-11-7-19(8-12-21)24-17-25(20-9-13-22(37-4)14-10-20)36(34-24)28-32-26(29-2)31-27(30-3)33-28/h5-17,35H,1-4H3,(H2,29,30,31,32,33)
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n/an/a 666n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair
Matrix metalloproteinase-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199120
PNG
(N-(4-(1-(4,6-bis(ethylamino)-1,3,5-triazin-2-yl)-5...)
Show SMILES CCNc1nc(NCC)nc(n1)-n1nc(cc1-c1ccc(OC)cc1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C30H32N8O3S/c1-5-31-28-33-29(32-6-2)35-30(34-28)38-27(22-11-15-24(39-4)16-12-22)19-26(36-38)21-9-13-23(14-10-21)37-40-41-42-25-17-7-20(3)8-18-25/h7-19,37H,5-6H2,1-4H3,(H2,31,32,33,34,35)
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n/an/a 332n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair
Matrix metalloproteinase-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199121
PNG
(N-(4-(1-(4,6-bis((3-aminopropyl)amino)-1,3,5-triaz...)
Show SMILES COc1ccc(cc1)-c1cc(nn1-c1nc(NCCCN)nc(NCCCN)n1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C32H38N10O3S/c1-22-5-15-27(16-6-22)46-45-44-41-25-11-7-23(8-12-25)28-21-29(24-9-13-26(43-2)14-10-24)42(40-28)32-38-30(35-19-3-17-33)37-31(39-32)36-20-4-18-34/h5-16,21,41H,3-4,17-20,33-34H2,1-2H3,(H2,35,36,37,38,39)
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n/an/a 189n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair
Matrix metalloproteinase-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199122
PNG
(N-(4-(1-(4,6-bis(phenylamino)-1,3,5-triazin-2-yl)-...)
Show SMILES COc1ccc(cc1)-c1cc(nn1-c1nc(Nc2ccccc2)nc(Nc2ccccc2)n1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C38H32N8O3S/c1-26-13-23-33(24-14-26)50-49-48-45-31-19-15-27(16-20-31)34-25-35(28-17-21-32(47-2)22-18-28)46(44-34)38-42-36(39-29-9-5-3-6-10-29)41-37(43-38)40-30-11-7-4-8-12-30/h3-25,45H,1-2H3,(H2,39,40,41,42,43)
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n/an/a 123n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair
Matrix metalloproteinase-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199128
PNG
(N-(4-(1-(4,6-dimorpholino-1,3,5-triazin-2-yl)-5-(4...)
Show SMILES COc1ccc(cc1)-c1cc(nn1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C34H36N8O5S/c1-24-3-13-29(14-4-24)48-47-46-39-27-9-5-25(6-10-27)30-23-31(26-7-11-28(43-2)12-8-26)42(38-30)34-36-32(40-15-19-44-20-16-40)35-33(37-34)41-17-21-45-22-18-41/h3-14,23,39H,15-22H2,1-2H3
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n/an/a 42.3n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair
Matrix metalloproteinase-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199124
PNG
(N-(4-(1-(4,6-bis((4-methoxyphenyl)amino)-1,3,5-tri...)
Show SMILES COc1ccc(Nc2nc(Nc3ccc(OC)cc3)nc(n2)-n2nc(cc2-c2ccc(OC)cc2)-c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2)cc1
Show InChI InChI=1S/C40H36N8O5S/c1-26-5-23-35(24-6-26)54-53-52-47-31-11-7-27(8-12-31)36-25-37(28-9-17-32(49-2)18-10-28)48(46-36)40-44-38(41-29-13-19-33(50-3)20-14-29)43-39(45-40)42-30-15-21-34(51-4)22-16-30/h5-25,47H,1-4H3,(H2,41,42,43,44,45)
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n/an/a 18.6n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair
Matrix metalloproteinase-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199125
PNG
(N-(4-(1-(4,6-bis(o-tolylamino)-1,3,5-triazin-2-yl)...)
Show SMILES COc1ccc(cc1)-c1cc(nn1-c1nc(Nc2ccccc2C)nc(Nc2ccccc2C)n1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C40H36N8O3S/c1-26-13-23-33(24-14-26)52-51-50-47-31-19-15-29(16-20-31)36-25-37(30-17-21-32(49-4)22-18-30)48(46-36)40-44-38(41-34-11-7-5-9-27(34)2)43-39(45-40)42-35-12-8-6-10-28(35)3/h5-25,47H,1-4H3,(H2,41,42,43,44,45)
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n/an/a 67.1n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair
Matrix metalloproteinase-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199126
PNG
(N-(4-(1-(4,6-bis((4-nitrophenyl)amino)-1,3,5-triaz...)
Show SMILES COc1ccc(cc1)-c1cc(nn1-c1nc(Nc2ccc(cc2)[N+]([O-])=O)nc(Nc2ccc(cc2)[N+]([O-])=O)n1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C38H30N10O7S/c1-24-3-21-33(22-4-24)56-55-54-45-29-9-5-25(6-10-29)34-23-35(26-7-19-32(53-2)20-8-26)46(44-34)38-42-36(39-27-11-15-30(16-12-27)47(49)50)41-37(43-38)40-28-13-17-31(18-14-28)48(51)52/h3-23,45H,1-2H3,(H2,39,40,41,42,43)
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PC sid
UniChem
Article
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n/an/a 76.6n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair
Matrix metalloproteinase-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199127
PNG
(N-(4-(1-(4,6-di(piperazin-1-yl)-1,3,5-triazin-2-yl...)
Show SMILES COc1ccc(cc1)-c1cc(nn1-c1nc(nc(n1)N1CCNCC1)N1CCNCC1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C34H38N10O3S/c1-24-3-13-29(14-4-24)48-47-46-41-27-9-5-25(6-10-27)30-23-31(26-7-11-28(45-2)12-8-26)44(40-30)34-38-32(42-19-15-35-16-20-42)37-33(39-34)43-21-17-36-18-22-43/h3-14,23,35-36,41H,15-22H2,1-2H3
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UniChem
Article
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n/an/a 55.3n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair
Matrix metalloproteinase-2 (MMP-2)


(Rattus norvegicus (Rat))
BDBM199123
PNG
(N-(4-(1-(4,6-bis((4-hydroxyphenyl)amino)-1,3,5-tri...)
Show SMILES COc1ccc(cc1)-c1cc(nn1-c1nc(Nc2ccc(O)cc2)nc(Nc2ccc(O)cc2)n1)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
Show InChI InChI=1S/C38H32N8O5S/c1-24-3-21-33(22-4-24)52-51-50-45-29-9-5-25(6-10-29)34-23-35(26-7-19-32(49-2)20-8-26)46(44-34)38-42-36(39-27-11-15-30(47)16-12-27)41-37(43-38)40-28-13-17-31(48)18-14-28/h3-23,45,47-48H,1-2H3,(H2,39,40,41,42,43)
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Article
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n/an/a 8.12n/an/an/an/a7.525



Zhejiang Hospital



Assay Description
where a pro-fluorescing peptide is used as substrate, and the fluorogenic activity of its cleavage product is measured after co-incubation with the a...


Chem Biol Drug Des 88: 756-765 (2016)


Article DOI: 10.1111/cbdd.12807
BindingDB Entry DOI: 10.7270/Q2ZW1JR4
More data for this
Ligand-Target Pair