BDBM53816 (6Z)-5-azanylidene-6-[(5-phenylfuran-2-yl)methylidene]-3-propan-2-ylsulfonyl-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one::(6Z)-5-imino-3-(isopropylsulfonyl)-6-[(5-phenyl-2-furyl)methylene]-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one::(6Z)-5-imino-3-isopropylsulfonyl-6-[(5-phenyl-2-furyl)methylene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one::(6Z)-5-imino-6-[(5-phenyl-2-furanyl)methylidene]-3-propan-2-ylsulfonyl-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one::(6Z)-5-imino-6-[(5-phenylfuran-2-yl)methylidene]-3-propan-2-ylsulfonyl-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one::MLS000583145::SMR000206331::cid_12005262

SMILES CC(C)S(=O)(=O)C1=NSC2=NC(=O)\C(=C/c3ccc(o3)-c3ccccc3)C(=N)N12

InChI Key InChIKey=ZHRSARYFPYGZLY-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 53816   

TargetM1 family aminopeptidase(Plasmodium falciparum (isolate FcB1 / Columbia))
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM53816((6Z)-5-imino-6-[(5-phenyl-2-furanyl)methylidene]-3...)
Affinity DataIC50: 4.56E+4nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2011
Entry Details
PCBioAssay
TargetM17 leucyl aminopeptidase(Plasmodium falciparum (isolate 3D7))
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM53816((6Z)-5-imino-6-[(5-phenyl-2-furanyl)methylidene]-3...)
Affinity DataIC50: 1.26E+4nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/8/2011
Entry Details
PCBioAssay
TargetEnvelope glycoprotein gp160(Human immunodeficiency virus type 1)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM53816((6Z)-5-imino-6-[(5-phenyl-2-furanyl)methylidene]-3...)
Affinity DataIC50: 9.65E+3nMAssay Description:Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/30/2011
Entry Details
PCBioAssay
TargetEnvelope glycoprotein gp160(Human immunodeficiency virus type 1)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM53816((6Z)-5-imino-6-[(5-phenyl-2-furanyl)methylidene]-3...)
Affinity DataIC50: 3.20E+3nMAssay Description:Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/31/2011
Entry Details
PCBioAssay