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BDBM50128646 4-(4-Methoxy-benzenesulfonyl)-1-phenethyl-piperidine-4-carboxylic acid hydroxyamide::CHEMBL310057::N-hydroxy-4-(4-methoxyphenylsulfonyl)-1-phenethylpiperidine-4-carboxamide

SMILES: COc1ccc(cc1)S(=O)(=O)C1(CCN(CCc2ccccc2)CC1)C(=O)NO

InChI Key: InChIKey=KASLMAICRUMQME-UHFFFAOYSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50128646   
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
Interstitial collagenase


(Homo sapiens (Human))
BDBM50128646
PNG
(4-(4-Methoxy-benzenesulfonyl)-1-phenethyl-piperidi...)
Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(CCc2ccccc2)CC1)C(=O)NO
Show InChI InChI=1S/C21H26N2O5S/c1-28-18-7-9-19(10-8-18)29(26,27)21(20(24)22-25)12-15-23(16-13-21)14-11-17-5-3-2-4-6-17/h2-10,25H,11-16H2,1H3,(H,22,24)
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Article
PubMed
n/an/a 1.31E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against matrix metalloprotease-1


J Med Chem 46: 2376-96 (2003)


Article DOI: 10.1021/jm0205550
BindingDB Entry DOI: 10.7270/Q2N0178C
More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17


(Homo sapiens (Human))
BDBM50128646
PNG
(4-(4-Methoxy-benzenesulfonyl)-1-phenethyl-piperidi...)
Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(CCc2ccccc2)CC1)C(=O)NO
Show InChI InChI=1S/C21H26N2O5S/c1-28-18-7-9-19(10-8-18)29(26,27)21(20(24)22-25)12-15-23(16-13-21)14-11-17-5-3-2-4-6-17/h2-10,25H,11-16H2,1H3,(H,22,24)
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Article
PubMed
n/an/a 470n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against tumor necrosis factor alpha converting enzyme (TACE).


J Med Chem 46: 2376-96 (2003)


Article DOI: 10.1021/jm0205550
BindingDB Entry DOI: 10.7270/Q2N0178C
More data for this
Ligand-Target Pair
Collagenase 3


(Homo sapiens (Human))
BDBM50128646
PNG
(4-(4-Methoxy-benzenesulfonyl)-1-phenethyl-piperidi...)
Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(CCc2ccccc2)CC1)C(=O)NO
Show InChI InChI=1S/C21H26N2O5S/c1-28-18-7-9-19(10-8-18)29(26,27)21(20(24)22-25)12-15-23(16-13-21)14-11-17-5-3-2-4-6-17/h2-10,25H,11-16H2,1H3,(H,22,24)
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Article
PubMed
n/an/a 9n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against matrix metalloprotease-13.


J Med Chem 46: 2376-96 (2003)


Article DOI: 10.1021/jm0205550
BindingDB Entry DOI: 10.7270/Q2N0178C
More data for this
Ligand-Target Pair
Matrix metalloproteinase-9


(Homo sapiens (Human))
BDBM50128646
PNG
(4-(4-Methoxy-benzenesulfonyl)-1-phenethyl-piperidi...)
Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(CCc2ccccc2)CC1)C(=O)NO
Show InChI InChI=1S/C21H26N2O5S/c1-28-18-7-9-19(10-8-18)29(26,27)21(20(24)22-25)12-15-23(16-13-21)14-11-17-5-3-2-4-6-17/h2-10,25H,11-16H2,1H3,(H,22,24)
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Article
PubMed
n/an/a 45n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against matrix metalloprotease-9.


J Med Chem 46: 2376-96 (2003)


Article DOI: 10.1021/jm0205550
BindingDB Entry DOI: 10.7270/Q2N0178C
More data for this
Ligand-Target Pair