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PubMed code 17574851

Compile data set for download or QSAR
Found 10 hits of Enzyme Inhibition Constant Data   
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
Macrophage metalloelastase


(Homo sapiens (Human))		BDBM50215926
PNG
(4-(4,5-dibromo-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]py...)
Show SMILES Nc1nc2c(nccc2[nH]1)-c1cc(Br)c(Br)[nH]1
Show InChI InChI=1S/C10H7Br2N5/c11-4-3-6(15-9(4)12)7-8-5(1-2-14-7)16-10(13)17-8/h1-3,15H,(H3,13,16,17)
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PubMed
n/an/a 3.66E+3n/an/an/an/an/an/a



Kyorin Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MMP12

Bioorg Med Chem Lett 17: 4495-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.005
BindingDB Entry DOI: 10.7270/Q2MW2GVX
More data for this
Ligand-Target Pair
Macrophage metalloelastase


(Homo sapiens (Human))		BDBM50215933
PNG
(4-(4,5-dibromo-1H-pyrrol-2-yl)-N-methyl-1H-imidazo...)
Show SMILES CNc1nc2c(nccc2[nH]1)-c1cc(Br)c(Br)[nH]1
Show InChI InChI=1S/C11H9Br2N5/c1-14-11-17-6-2-3-15-8(9(6)18-11)7-4-5(12)10(13)16-7/h2-4,16H,1H3,(H2,14,17,18)
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n/an/a 1.04E+4n/an/an/an/an/an/a



Kyorin Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MMP12

Bioorg Med Chem Lett 17: 4495-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.005
BindingDB Entry DOI: 10.7270/Q2MW2GVX
More data for this
Ligand-Target Pair
Macrophage metalloelastase


(Homo sapiens (Human))		BDBM50215931
PNG
(4-(4,5-dibromo-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]py...)
Show SMILES Brc1cc([nH]c1Br)-c1nccc2[nH]cnc12
Show InChI InChI=1S/C10H6Br2N4/c11-5-3-7(16-10(5)12)9-8-6(1-2-13-9)14-4-15-8/h1-4,16H,(H,14,15)
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n/an/a 4.36E+4n/an/an/an/an/an/a



Kyorin Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MMP12

Bioorg Med Chem Lett 17: 4495-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.005
BindingDB Entry DOI: 10.7270/Q2MW2GVX
More data for this
Ligand-Target Pair
Macrophage metalloelastase


(Homo sapiens (Human))		BDBM50215934
PNG
(4-(4,5-dibromo-1H-pyrrol-2-yl)-1-methyl-1H-imidazo...)
Show SMILES Cn1c(N)nc2c(nccc12)-c1cc(Br)c(Br)[nH]1
Show InChI InChI=1S/C11H9Br2N5/c1-18-7-2-3-15-8(9(7)17-11(18)14)6-4-5(12)10(13)16-6/h2-4,16H,1H3,(H2,14,17)
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n/an/a 5.69E+4n/an/an/an/an/an/a



Kyorin Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MMP12

Bioorg Med Chem Lett 17: 4495-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.005
BindingDB Entry DOI: 10.7270/Q2MW2GVX
More data for this
Ligand-Target Pair
Macrophage metalloelastase


(Homo sapiens (Human))		BDBM50215925
PNG
(4-(4,5-dibromo-1H-pyrrol-2-yl)-N,N-dimethyl-1H-imi...)
Show SMILES CN(C)c1nc2c(nccc2[nH]1)-c1cc(Br)c(Br)[nH]1
Show InChI InChI=1S/C12H11Br2N5/c1-19(2)12-17-7-3-4-15-9(10(7)18-12)8-5-6(13)11(14)16-8/h3-5,16H,1-2H3,(H,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Kyorin Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MMP12

Bioorg Med Chem Lett 17: 4495-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.005
BindingDB Entry DOI: 10.7270/Q2MW2GVX
More data for this
Ligand-Target Pair
Macrophage metalloelastase


(Homo sapiens (Human))		BDBM50215932
PNG
(4-(4,5-dibromo-1-methyl-1H-pyrrol-2-yl)-1H-imidazo...)
Show SMILES Cn1c(Br)c(Br)cc1-c1nccc2[nH]c(N)nc12
Show InChI InChI=1S/C11H9Br2N5/c1-18-7(4-5(12)10(18)13)9-8-6(2-3-15-9)16-11(14)17-8/h2-4H,1H3,(H3,14,16,17)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Kyorin Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MMP12

Bioorg Med Chem Lett 17: 4495-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.005
BindingDB Entry DOI: 10.7270/Q2MW2GVX
More data for this
Ligand-Target Pair
Macrophage metalloelastase


(Homo sapiens (Human))		BDBM50215929
PNG
(4-(4,5-dibromo-1H-pyrrol-2-yl)-N,1-dimethyl-1H-imi...)
Show SMILES CNc1nc2c(nccc2n1C)-c1cc(Br)c(Br)[nH]1
Show InChI InChI=1S/C12H11Br2N5/c1-15-12-18-10-8(19(12)2)3-4-16-9(10)7-5-6(13)11(14)17-7/h3-5,17H,1-2H3,(H,15,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Kyorin Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MMP12

Bioorg Med Chem Lett 17: 4495-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.005
BindingDB Entry DOI: 10.7270/Q2MW2GVX
More data for this
Ligand-Target Pair
Macrophage metalloelastase


(Homo sapiens (Human))		BDBM50215930
PNG
(4-(5-bromo-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridi...)
Show SMILES Nc1nc2c(nccc2[nH]1)-c1ccc(Br)[nH]1
Show InChI InChI=1S/C10H8BrN5/c11-7-2-1-5(14-7)8-9-6(3-4-13-8)15-10(12)16-9/h1-4,14H,(H3,12,15,16)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Kyorin Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MMP12

Bioorg Med Chem Lett 17: 4495-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.005
BindingDB Entry DOI: 10.7270/Q2MW2GVX
More data for this
Ligand-Target Pair
Macrophage metalloelastase


(Homo sapiens (Human))		BDBM50215927
PNG
(4-(1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridin-2-amin...)
Show SMILES Nc1nc2c(nccc2[nH]1)-c1ccc[nH]1
Show InChI InChI=1S/C10H9N5/c11-10-14-7-3-5-13-8(9(7)15-10)6-2-1-4-12-6/h1-5,12H,(H3,11,14,15)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Kyorin Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MMP12

Bioorg Med Chem Lett 17: 4495-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.005
BindingDB Entry DOI: 10.7270/Q2MW2GVX
More data for this
Ligand-Target Pair
Macrophage metalloelastase


(Homo sapiens (Human))		BDBM50215928
PNG
(4-(4-bromo-1H-pyrrol-2-yl)-1H-imidazo[4,5-c]pyridi...)
Show SMILES Nc1nc2c(nccc2[nH]1)-c1cc(Br)c[nH]1
Show InChI InChI=1S/C10H8BrN5/c11-5-3-7(14-4-5)8-9-6(1-2-13-8)15-10(12)16-9/h1-4,14H,(H3,12,15,16)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Kyorin Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of MMP12

Bioorg Med Chem Lett 17: 4495-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.005
BindingDB Entry DOI: 10.7270/Q2MW2GVX
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%