BDBM87289 2-[[4-[(5-methyl-2-thiazolin-2-yl)amino]anilino]methylene]malonic acid diethyl ester::2-[[4-[(5-methyl-4,5-dihydrothiazol-2-yl)amino]anilino]methylidene]propanedioic acid diethyl ester::MLS000700484::SMR000225883::cid_389166::diethyl 2-({4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]anilino}methylene)malonate::diethyl 2-[[4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]anilino]methylidene]propanedioate::diethyl 2-[[[4-[(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenyl]amino]methylidene]propanedioate

SMILES CCOC(=O)C(C=Nc1ccc(NC2=NCC(C)S2)cc1)C(=O)OCC

InChI Key InChIKey=MKQXETKEWOIERT-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 87289   

TargetTegument protein VP16(HHV-1)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM87289(MLS000700484 | cid_389166 | diethyl 2-[[[4-[(5-met...)
Affinity DataIC50: 1.57E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2012
Entry Details
PCBioAssay
TargetNuclear receptor coactivator 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM87289(MLS000700484 | cid_389166 | diethyl 2-[[[4-[(5-met...)
Affinity DataIC50: 3.58E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2012
Entry Details
PCBioAssay
TargetNuclear receptor coactivator 3(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM87289(MLS000700484 | cid_389166 | diethyl 2-[[[4-[(5-met...)
Affinity DataIC50: 3.32E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2012
Entry Details
PCBioAssay