BDBM113941 2-[4-(2,6-dimethylphenyl)benzyl]-5-[[1-(2-hydroxyethyl)triazol-4-yl]methyl]-3-isobutyl-1,1-diketo-1,2,5-thiadiazepan-4-one::2-[[4-(2,6-dimethylphenyl)phenyl]methyl]-5-[[1-(2-hydroxyethyl)-1,2,3-triazol-4-yl]methyl]-3-(2-methylpropyl)-1,1-bis(oxidanylidene)-1,2,5-thiadiazepan-4-one::2-[[4-(2,6-dimethylphenyl)phenyl]methyl]-5-[[1-(2-hydroxyethyl)-4-triazolyl]methyl]-3-(2-methylpropyl)-1,1-dioxo-1,2,5-thiadiazepan-4-one::2-[[4-(2,6-dimethylphenyl)phenyl]methyl]-5-[[1-(2-hydroxyethyl)triazol-4-yl]methyl]-3-(2-methylpropyl)-1,1-dioxo-1,2,5-thiadiazepan-4-one::KUC103947::MLS002768202::SMR001788144::cid_45479948

SMILES CC(C)CC1N(Cc2ccc(cc2)-c2c(C)cccc2C)S(=O)(=O)CCN(Cc2cn(CCO)nn2)C1=O

InChI Key InChIKey=UVXGGJFEGBCHNS-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 113941   

TargetDisintegrin and metalloproteinase domain-containing protein 10(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM113941(2-[[4-(2,6-dimethylphenyl)phenyl]methyl]-5-[[1-(2-...)
Affinity DataIC50: 1.23E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Torrey Pines Institute for Molecul...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/8/2014
Entry Details
PCBioAssay
TargetDisintegrin and metalloproteinase domain-containing protein 17(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM113941(2-[[4-(2,6-dimethylphenyl)phenyl]methyl]-5-[[1-(2-...)
Affinity DataIC50: 6.95E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Torrey Pines Institute for Molecul...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/8/2014
Entry Details
PCBioAssay