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BDBM50128661 4-(4-Methoxy-benzenesulfonyl)-1-methyl-piperidine-4-carboxylic acid hydroxyamide::CHEMBL312585::N-hydroxy-4-(4-methoxyphenylsulfonyl)-1-methylpiperidine-4-carboxamide

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

InChI Key: InChIKey=RBRSAOMOZVVQSQ-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50128661   
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))
BDBM50128661
PNG
(4-(4-Methoxy-benzenesulfonyl)-1-methyl-piperidine-...)
Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(C)CC1)C(=O)NO
Show InChI InChI=1S/C14H20N2O5S/c1-16-9-7-14(8-10-16,13(17)15-18)22(19,20)12-5-3-11(21-2)4-6-12/h3-6,18H,7-10H2,1-2H3,(H,15,17)
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MMDB

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Article
PubMed
n/an/a 5.11E+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
Collagenase 3


(Homo sapiens (Human))
BDBM50128661
PNG
(4-(4-Methoxy-benzenesulfonyl)-1-methyl-piperidine-...)
Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(C)CC1)C(=O)NO
Show InChI InChI=1S/C14H20N2O5S/c1-16-9-7-14(8-10-16,13(17)15-18)22(19,20)12-5-3-11(21-2)4-6-12/h3-6,18H,7-10H2,1-2H3,(H,15,17)
PDB
MMDB

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Article
PubMed
n/an/a 44n/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))
BDBM50128661
PNG
(4-(4-Methoxy-benzenesulfonyl)-1-methyl-piperidine-...)
Show SMILES COc1ccc(cc1)S(=O)(=O)C1(CCN(C)CC1)C(=O)NO
Show InChI InChI=1S/C14H20N2O5S/c1-16-9-7-14(8-10-16,13(17)15-18)22(19,20)12-5-3-11(21-2)4-6-12/h3-6,18H,7-10H2,1-2H3,(H,15,17)
PDB
MMDB

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UniProtKB/SwissProt

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DrugBank
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PC cid
PC sid
UniChem

Patents


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Article
PubMed
n/an/a 484n/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