BDBM83928 3-(3-Morpholin-4-yl-1,4-dioxo-1,4-dihydro-naphthalen-2-ylamino)-benzoic acid::3-[(1,4-diketo-3-morpholino-2-naphthyl)amino]benzoic acid::3-[(3-morpholin-4-yl-1,4-dioxonaphthalen-2-yl)amino]benzoic acid::3-[[3-(4-morpholinyl)-1,4-dioxo-2-naphthalenyl]amino]benzoic acid::3-[[3-morpholin-4-yl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]benzoic acid::MLS000777939::SMR000414333::cid_1385360

SMILES OC(=O)c1cccc(NC2=C(N3CCOCC3)C(=O)c3ccccc3C2=O)c1

InChI Key InChIKey=RKRRTHBMNDJIQQ-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 = 83928   

TargetApoptotic protease-activating factor 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 83928BDBM83928(3-(3-Morpholin-4-yl-1,4-dioxo-1,4-dihydro-naphthal...)
Affinity DataIC50: 1.48E+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
TargetCaspase-9(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 83928BDBM83928(3-(3-Morpholin-4-yl-1,4-dioxo-1,4-dihydro-naphthal...)
Affinity DataIC50: 1.57E+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
LigandChemical structure of BindingDB Monomer ID 83928BDBM83928(3-(3-Morpholin-4-yl-1,4-dioxo-1,4-dihydro-naphthal...)
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