BDBM50496 (6Z)-5-azanylidene-6-[[1-(4-methylphenyl)pyrrol-2-yl]methylidene]-3-methylsulfonyl-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one::(6Z)-5-imino-3-mesyl-6-[[1-(p-tolyl)pyrrol-2-yl]methylene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one::(6Z)-5-imino-6-[[1-(4-methylphenyl)-2-pyrrolyl]methylidene]-3-methylsulfonyl-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one::(6Z)-5-imino-6-[[1-(4-methylphenyl)pyrrol-2-yl]methylidene]-3-methylsulfonyl-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one::(6Z)-5-imino-6-{[1-(4-methylphenyl)-1H-pyrrol-2-yl]methylene}-3-(methylsulfonyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one::MLS000871659::SMR000309178::cid_16194365

SMILES Cc1ccc(cc1)-n1cccc1\C=C1/C(=O)N=C2SN=C(N2C1=N)S(C)(=O)=O

InChI Key InChIKey=KRRROLDQDLWUGG-UHFFFAOYSA-N

Data  3 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50496   

LigandPNGBDBM50496((6Z)-5-imino-6-{[1-(4-methylphenyl)-1H-pyrrol-2-yl...)
Affinity DataIC50: 5.52E+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
Target26S proteasome non-ATPase regulatory subunit 14(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM50496((6Z)-5-imino-6-{[1-(4-methylphenyl)-1H-pyrrol-2-yl...)
Affinity DataIC50: 2.62E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford Burnham Medical Research Institute (SBMRI, La Jolla, CA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2012
Entry Details
PCBioAssay
TargetProthrombin(Bovine)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM50496((6Z)-5-imino-6-{[1-(4-methylphenyl)-1H-pyrrol-2-yl...)
Affinity DataIC50: 8.69E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford Burnham Medical Research Institute (SBMRI, La Jolla, CA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2012
Entry Details
PCBioAssay