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10 similar compounds to monomer 50089197

Compile data set for download or QSAR
Wt: 299.3
BDBM50089210
Wt: 299.3
BDBM50089212
Wt: 348.2
BDBM50089214
Wt: 285.3
BDBM50089196
Wt: 335.4
BDBM50089199
Wt: 364.2
BDBM50089200
Wt: 319.4
BDBM50089204
Wt: 271.3
BDBM50089208
Wt: 285.3
BDBM50369525
Wt: 285.3
BDBM50408913

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 35 hits for monomerid = 50089210,50089212,50089214,50089196,50089199,50089200,50089204,50089208,50369525,50408913   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Neutral Endopeptidase (NEP)


(Rattus norvegicus (Rat))
BDBM50089196
PNG
(3-Benzenesulfonyl-heptanoic acid hydroxyamide | CH...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)
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n/an/a 1.80E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against neutral endopeptidase enzyme (NEP).


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50408913
PNG
(CHEMBL2092878)
Show SMILES CCCC[C@@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m0/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against isolated Escherichia coli peptidyl deformylase (PDF) enzyme containing iron.


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50089199
PNG
(3-(Naphthalene-2-sulfonyl)-heptanoic acid hydroxya...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C17H21NO4S/c1-2-3-8-15(12-17(19)18-20)23(21,22)16-10-9-13-6-4-5-7-14(13)11-16/h4-7,9-11,15,20H,2-3,8,12H2,1H3,(H,18,19)
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n/an/a 9n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-13


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Homo sapiens (Human))
BDBM50369525
PNG
(CHEMBL1788203)
Show SMILES CCCC[C@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m1/s1
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n/an/a 3.40E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against angiotensin I converting enzyme (ACE)


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50089200
PNG
(3-(4-Bromo-benzenesulfonyl)-heptanoic acid hydroxy...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C13H18BrNO4S/c1-2-3-4-12(9-13(16)15-17)20(18,19)11-7-5-10(14)6-8-11/h5-8,12,17H,2-4,9H2,1H3,(H,15,16)
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n/an/a 120n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against isolated Escherichia coli peptidyl deformylase (PDF) enzyme containing iron.


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Endothelin-converting enzyme 1 (ECE1)


(Homo sapiens (Human))
BDBM50369525
PNG
(CHEMBL1788203)
Show SMILES CCCC[C@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Endothelin-converting enzyme 1


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50089199
PNG
(3-(Naphthalene-2-sulfonyl)-heptanoic acid hydroxya...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C17H21NO4S/c1-2-3-8-15(12-17(19)18-20)23(21,22)16-10-9-13-6-4-5-7-14(13)11-16/h4-7,9-11,15,20H,2-3,8,12H2,1H3,(H,18,19)
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n/an/a 23n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against isolated Escherichia coli peptidyl deformylase (PDF) enzyme containing iron.


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM50369525
PNG
(CHEMBL1788203)
Show SMILES CCCC[C@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m1/s1
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n/an/a 42n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of human Matrix metalloprotease-12


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM50089199
PNG
(3-(Naphthalene-2-sulfonyl)-heptanoic acid hydroxya...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C17H21NO4S/c1-2-3-8-15(12-17(19)18-20)23(21,22)16-10-9-13-6-4-5-7-14(13)11-16/h4-7,9-11,15,20H,2-3,8,12H2,1H3,(H,18,19)
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n/an/a 13n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of human Matrix metalloprotease-12


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50369525
PNG
(CHEMBL1788203)
Show SMILES CCCC[C@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m1/s1
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n/an/a 16n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against isolated Escherichia coli peptidyl deformylase (PDF) enzyme containing iron.


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM50089196
PNG
(3-Benzenesulfonyl-heptanoic acid hydroxyamide | CH...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)
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n/an/a 110n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-1


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Neutral Endopeptidase (NEP)


(Rattus norvegicus (Rat))
BDBM50369525
PNG
(CHEMBL1788203)
Show SMILES CCCC[C@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m1/s1
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n/an/a 2.50E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against endopeptidase enzyme (NEP).


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50369525
PNG
(CHEMBL1788203)
Show SMILES CCCC[C@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m1/s1
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n/an/a 79n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-13


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50089204
PNG
(3-(Naphthalene-2-sulfinyl)-heptanoic acid hydroxya...)
Show SMILES CCCCC(CC(=O)NO)S(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C17H21NO3S/c1-2-3-8-15(12-17(19)18-20)22(21)16-10-9-13-6-4-5-7-14(13)11-16/h4-7,9-11,15,20H,2-3,8,12H2,1H3,(H,18,19)
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n/an/a 64n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against isolated Escherichia coli peptidyl deformylase (PDF) enzyme containing iron.


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Neutral Endopeptidase (NEP)


(Rattus norvegicus (Rat))
BDBM50089199
PNG
(3-(Naphthalene-2-sulfonyl)-heptanoic acid hydroxya...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C17H21NO4S/c1-2-3-8-15(12-17(19)18-20)23(21,22)16-10-9-13-6-4-5-7-14(13)11-16/h4-7,9-11,15,20H,2-3,8,12H2,1H3,(H,18,19)
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n/an/a 500n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against endopeptidase enzyme (NEP).


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Endothelin-converting enzyme 1 (ECE1)


(Homo sapiens (Human))
BDBM50089196
PNG
(3-Benzenesulfonyl-heptanoic acid hydroxyamide | CH...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)
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n/an/a>5.00E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Endothelin-converting enzyme 1


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Homo sapiens (Human))
BDBM50089199
PNG
(3-(Naphthalene-2-sulfonyl)-heptanoic acid hydroxya...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C17H21NO4S/c1-2-3-8-15(12-17(19)18-20)23(21,22)16-10-9-13-6-4-5-7-14(13)11-16/h4-7,9-11,15,20H,2-3,8,12H2,1H3,(H,18,19)
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n/an/a 1.24E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against angiotensin I converting enzyme (ACE)


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50089210
PNG
(3-(4-Methoxy-benzenesulfinyl)-heptanoic acid hydro...)
Show SMILES CCCCC(CC(=O)NO)S(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C14H21NO4S/c1-3-4-5-13(10-14(16)15-17)20(18)12-8-6-11(19-2)7-9-12/h6-9,13,17H,3-5,10H2,1-2H3,(H,15,16)
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n/an/a 99n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against isolated Escherichia coli peptidyl deformylase (PDF) enzyme containing iron.


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50089208
PNG
(3-Benzenesulfonyl-hexanoic acid hydroxyamide | CHE...)
Show SMILES CCCC(CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C12H17NO4S/c1-2-6-11(9-12(14)13-15)18(16,17)10-7-4-3-5-8-10/h3-5,7-8,11,15H,2,6,9H2,1H3,(H,13,14)
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n/an/a 160n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against isolated Escherichia coli peptidyl deformylase (PDF) enzyme containing iron.


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50089212
PNG
(3-Benzenesulfonyl-octanoic acid hydroxyamide | CHE...)
Show SMILES CCCCCC(CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C14H21NO4S/c1-2-3-5-10-13(11-14(16)15-17)20(18,19)12-8-6-4-7-9-12/h4,6-9,13,17H,2-3,5,10-11H2,1H3,(H,15,16)
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n/an/a 140n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against isolated Escherichia coli peptidyl deformylase (PDF) enzyme containing iron.


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Endothelin-converting enzyme 1 (ECE1)


(Homo sapiens (Human))
BDBM50089199
PNG
(3-(Naphthalene-2-sulfonyl)-heptanoic acid hydroxya...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C17H21NO4S/c1-2-3-8-15(12-17(19)18-20)23(21,22)16-10-9-13-6-4-5-7-14(13)11-16/h4-7,9-11,15,20H,2-3,8,12H2,1H3,(H,18,19)
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n/an/a 4.50E+5n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Endothelin-converting enzyme 1


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50089214
PNG
(3-(4-Bromo-benzenesulfinyl)-heptanoic acid hydroxy...)
Show SMILES CCCCC(CC(=O)NO)S(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C13H18BrNO3S/c1-2-3-4-12(9-13(16)15-17)19(18)11-7-5-10(14)6-8-11/h5-8,12,17H,2-4,9H2,1H3,(H,15,16)
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n/an/a 210n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against isolated Escherichia coli peptidyl deformylase (PDF) enzyme containing iron.


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM50089199
PNG
(3-(Naphthalene-2-sulfonyl)-heptanoic acid hydroxya...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C17H21NO4S/c1-2-3-8-15(12-17(19)18-20)23(21,22)16-10-9-13-6-4-5-7-14(13)11-16/h4-7,9-11,15,20H,2-3,8,12H2,1H3,(H,18,19)
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n/an/a 70n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-1


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Peptide deformylase


(Escherichia coli)
BDBM50089196
PNG
(3-Benzenesulfonyl-heptanoic acid hydroxyamide | CH...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)
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n/an/a 35n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against isolated Escherichia coli peptidyl deformylase (PDF) enzyme containing iron.


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50089196
PNG
(3-Benzenesulfonyl-heptanoic acid hydroxyamide | CH...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)
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n/an/a 22n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-13


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7)


(Homo sapiens (Human))
BDBM50089196
PNG
(3-Benzenesulfonyl-heptanoic acid hydroxyamide | CH...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)
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n/an/a 1.10E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of matrilysin, Matrix metalloprotease-7


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM50089196
PNG
(3-Benzenesulfonyl-heptanoic acid hydroxyamide | CH...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)
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n/an/a 12n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of human Matrix metalloprotease-12


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Homo sapiens (Human))
BDBM50089196
PNG
(3-Benzenesulfonyl-heptanoic acid hydroxyamide | CH...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)
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n/an/a 8.10E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against angiotensin I converting enzyme (ACE)


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7)


(Homo sapiens (Human))
BDBM50089199
PNG
(3-(Naphthalene-2-sulfonyl)-heptanoic acid hydroxya...)
Show SMILES CCCCC(CC(=O)NO)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C17H21NO4S/c1-2-3-8-15(12-17(19)18-20)23(21,22)16-10-9-13-6-4-5-7-14(13)11-16/h4-7,9-11,15,20H,2-3,8,12H2,1H3,(H,18,19)
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n/an/a 1.50E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of matrilysin, Matrix metalloprotease-7


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM50369525
PNG
(CHEMBL1788203)
Show SMILES CCCC[C@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m1/s1
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n/an/a 150n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of Matrix metalloprotease-1


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Endothelin-converting enzyme 1 (ECE1)


(Homo sapiens (Human))
BDBM50408913
PNG
(CHEMBL2092878)
Show SMILES CCCC[C@@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Endothelin-converting enzyme 1


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Neutral Endopeptidase (NEP)


(Rattus norvegicus (Rat))
BDBM50408913
PNG
(CHEMBL2092878)
Show SMILES CCCC[C@@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m0/s1
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n/an/a 1.50E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against endopeptidase enzyme (NEP).


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12)


(Homo sapiens (Human))
BDBM50408913
PNG
(CHEMBL2092878)
Show SMILES CCCC[C@@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m0/s1
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n/an/a 9n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of human Matrix metalloprotease-12


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7)


(Homo sapiens (Human))
BDBM50408913
PNG
(CHEMBL2092878)
Show SMILES CCCC[C@@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m0/s1
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n/an/a 1.20E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of matrilysin, Matrix metalloprotease-7


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7)


(Homo sapiens (Human))
BDBM50369525
PNG
(CHEMBL1788203)
Show SMILES CCCC[C@H](CC(=O)NO)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C13H19NO4S/c1-2-3-7-12(10-13(15)14-16)19(17,18)11-8-5-4-6-9-11/h4-6,8-9,12,16H,2-3,7,10H2,1H3,(H,14,15)/t12-/m1/s1
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n/an/a 2.10E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Inhibition of matrilysin, Matrix metalloprotease-7


J Med Chem 43: 2324-31 (2000)


Article DOI: 10.1021/jm000018k
BindingDB Entry DOI: 10.7270/Q2QF8TJR
More data for this
Ligand-Target Pair