BDBM83900 (3Z)-2-[3-(3-methylbutyl)imidazol-3-ium-1-yl]-4-oxidanylidene-3-(phenylsulfonylimino)naphthalen-1-olate::(3Z)-3-(benzenesulfonylimino)-2-[3-(3-methylbutyl)-1-imidazol-3-iumyl]-4-oxo-1-naphthalenolate::(3Z)-3-(benzenesulfonylimino)-2-[3-(3-methylbutyl)imidazol-3-ium-1-yl]-4-oxonaphthalen-1-olate::(3Z)-3-besylimino-2-(3-isoamylimidazol-3-ium-1-yl)-4-keto-naphthalen-1-olate::MLS000595317::SMR000149840::cid_9551857

SMILES CC(C)CC[n+]1ccn(c1)C1=C([N-]S(=O)(=O)c2ccccc2)C(=O)c2ccccc2C1=O

InChI Key InChIKey=OYDCHMZVJGLEJZ-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 83900   

TargetCaspase-9(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83900((3Z)-3-(benzenesulfonylimino)-2-[3-(3-methylbutyl)...)
Affinity DataIC50: 1.23E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/6/2012
Entry Details
PCBioAssay
TargetApoptotic protease-activating factor 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83900((3Z)-3-(benzenesulfonylimino)-2-[3-(3-methylbutyl)...)
Affinity DataIC50: 1.29E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2012
Entry Details
PCBioAssay
TargetApoptotic protease-activating factor 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83900((3Z)-3-(benzenesulfonylimino)-2-[3-(3-methylbutyl)...)
Affinity DataIC50: 1.00E+5nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2012
Entry Details
PCBioAssay