BDBM50176 (4E)-2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-[(4-methoxyphenyl)methylidene]pyrazol-3-one::(4E)-2-(1,3-benzothiazol-2-yl)-5-[[(4-chlorophenyl)thio]methyl]-4-[(4-methoxyphenyl)methylidene]-3-pyrazolone::(4E)-2-(1,3-benzothiazol-2-yl)-5-[[(4-chlorophenyl)thio]methyl]-4-p-anisylidene-2-pyrazolin-3-one::2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)thio]methyl}-4-(4-methoxybenzylidene)-2,4-dihydro-3H-pyrazol-3-one::MLS000571377::SMR000193462::cid_5727347

SMILES COc1ccc(C=c2c(=CSc3ccc(Cl)cc3)[nH]n(-c3nc4ccccc4s3)c2=O)cc1

InChI Key InChIKey=IVDGNZBDMVXNJN-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50176   

LigandPNGBDBM50176(SMR000193462 | (4E)-2-(1,3-benzothiazol-2-yl)-5-[[...)
Affinity DataIC50: 1.69E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay
TargetDNA (cytosine-5)-methyltransferase 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM50176(SMR000193462 | (4E)-2-(1,3-benzothiazol-2-yl)-5-[[...)
Affinity DataIC50: 2.86E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2012
Entry Details
PCBioAssay