BDBM113939 2-[(4-bromo-2-methyl-phenyl)thio]acetic acid [2-[4-(diethylamino)anilino]-2-keto-ethyl] ester;sulfuric acid::2-[(4-bromo-2-methylphenyl)thio]acetic acid [2-[4-(diethylamino)anilino]-2-oxoethyl] ester;sulfuric acid::MLS002635793::SMR000263687::[2-[4-(diethylamino)anilino]-2-oxoethyl] 2-(4-bromo-2-methylphenyl)sulfanylacetate;sulfuric acid::[2-[[4-(diethylamino)phenyl]amino]-2-oxidanylidene-ethyl] 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate;sulfuric acid::cid_12006230

SMILES CCN(CC)c1ccc(NC(=O)COC(=O)CSc2ccc(Br)cc2C)cc1

InChI Key InChIKey=CTXGONJTLPDCDQ-UHFFFAOYSA-N

Data  2 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 113939   

TargetDisintegrin and metalloproteinase domain-containing protein 17(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM113939(2-[(4-bromo-2-methylphenyl)thio]acetic acid [2-[4-...)
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
TargetDisintegrin and metalloproteinase domain-containing protein 10(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM113939(2-[(4-bromo-2-methylphenyl)thio]acetic acid [2-[4-...)
Affinity DataIC50: 7.72E+3nMAssay 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