BDBM50063920 (R)-N*1*-((S)-2,2-Dimethyl-1-methylcarbamoyl-propyl)-N*4*-hydroxy-2-isobutyl-succinamide::(R)-N1-((S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl)-N4-hydroxy-2-isobutylsuccinamide::CHEMBL16520::Ro-31-9790

SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)CC(=O)NO)C(C)(C)C

InChI Key InChIKey=QRXOZHSEEGNRFC-UHFFFAOYSA-N

Data  4 KI  11 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50063920   

TargetMatrix metalloproteinase-9(Human)
Wyeth-Ayerst Research

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 12nMAssay Description:Inhibition of matrix metalloprotease-9, gelatinase-BMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMatrix metalloproteinase-14(Human)
Kanebo

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 1.90nMAssay Description:Activity against deletion mutant of MT1-MMP lacking the transmembrane domain (deltaMT1)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMatrix metalloproteinase-9(Human)
Wyeth-Ayerst Research

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 12nMAssay Description:Activity against Matrix metalloprotease-9 (MMP-9).More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target72 kDa type IV collagenase(Human)
Kanebo

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 7.40nMAssay Description:Activity against Matrix metalloprotease-2 (MMP-2).More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetInterstitial collagenase(Human)
Kanebo

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 3nMAssay Description:Activity against Matrix metalloprotease-1 (MMP-1).More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetInterstitial collagenase(Human)
Kanebo

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 5nMAssay Description:Inhibition of matrix metalloprotease-1, Collagenase-1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetStromelysin-1(Human)
Wyeth-Ayerst Research

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 470nMAssay Description:Inhibition of matrix metalloprotease-3, stromelysin-1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of TNF(tumor necrosis factor) in human bloodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 20nMAssay Description:Inhibitory activity against Tumor necrosis factor alpha-converting enzyme (TACE) in blood.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetInterstitial collagenase(Human)
Kanebo

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 10nMAssay Description:Inhibitory activity against MMP-1 (Matrix metalloprotease-1)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetInterstitial collagenase(Human)
Kanebo

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataIC50: 5nMAssay Description:Inhibition of human MMP1More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/23/2013
Entry Details Article
PubMed
TargetMatrix metalloproteinase-9(Human)
Wyeth-Ayerst Research

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataKi:  2nMAssay Description:Inhibition of Matrix metalloprotease-9More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetInterstitial collagenase(Human)
Kanebo

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataKi:  2nMAssay Description:Inhibition of Matrix metalloprotease-1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataKi:  87nMAssay Description:Inhibition of TNF-alpha converting enzyme (TACE)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetStromelysin-1(Human)
Wyeth-Ayerst Research

Curated by ChEMBL
LigandPNGBDBM50063920(Ro-31-9790 | (R)-N*1*-((S)-2,2-Dimethyl-1-methylca...)
Affinity DataKi:  310nMAssay Description:Inhibition of Matrix metalloprotease-3More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed