BDBM50076993 (2S,11S,12R)-12-Isobutyl-13-oxo-1,7diaza-cyclotridecane-2,11-dicarboxylic acid 11-hydroxyamide 2-methylamide; hydrochloride::CHEMBL542068::CHEMBL88220

SMILES CNC(=O)[C@@H]1CCCCNCCC[C@@H]([C@@H](CC(C)C)C(=O)N1)C(=O)NO

InChI Key InChIKey=VOBIZCCABUHCMX-UHFFFAOYSA-N

Data  4 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50076993   

TargetDisintegrin and metalloproteinase domain-containing protein 17(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50076993(CHEMBL542068 | CHEMBL88220 | (2S,11S,12R)-12-Isobu...)
Affinity DataIC50: 2.70E+3nMAssay Description:Inhibition of LPS-stimulated TNF-alpha release in human whole bloodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/25/2012
Entry Details Article
PubMed
TargetInterstitial collagenase(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50076993(CHEMBL542068 | CHEMBL88220 | (2S,11S,12R)-12-Isobu...)
Affinity DataKi: <1nMAssay Description:In vitro inhibition of human MMP-1.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/25/2012
Entry Details Article
PubMed
TargetInterstitial collagenase(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50076993(CHEMBL542068 | CHEMBL88220 | (2S,11S,12R)-12-Isobu...)
Affinity DataKi: <1nMAssay Description:Inhibition of MMP-1 (human fibroblast collagenase)More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/30/2012
Entry Details Article
PubMed
TargetMatrix metalloproteinase-9(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50076993(CHEMBL542068 | CHEMBL88220 | (2S,11S,12R)-12-Isobu...)
Affinity DataKi:  13nMAssay Description:Inhibition of MMP-9 (matrix metalloprotease-9, gelatinase B)More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/30/2012
Entry Details Article
PubMed
TargetMatrix metalloproteinase-9(Human)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50076993(CHEMBL542068 | CHEMBL88220 | (2S,11S,12R)-12-Isobu...)
Affinity DataKi:  13nMAssay Description:In vitro inhibition of human MMP-9.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/25/2012
Entry Details Article
PubMed