BDBM83950 2-chloranyl-3-(2-morpholin-4-ylethylamino)naphthalene-1,4-dione::2-chloro-3-(2-morpholin-4-ylethylamino)naphthalene-1,4-dione::2-chloro-3-(2-morpholinoethylamino)-1,4-naphthoquinone::2-chloro-3-[(2-morpholinoethyl)amino]naphthoquinone::2-chloro-3-[2-(4-morpholinyl)ethylamino]naphthalene-1,4-dione::MLS001195486::SMR000550708::cid_312589

SMILES Oc1c(Cl)c(N=CCN2CCOCC2)c(O)c2ccccc12

InChI Key InChIKey=OMSLPKDYBIFPJY-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 83950   

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

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 83950BDBM83950(SMR000550708 | 2-chloranyl-3-(2-morpholin-4-ylethy...)
Affinity DataIC50: 2.20E+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 83950BDBM83950(SMR000550708 | 2-chloranyl-3-(2-morpholin-4-ylethy...)
Affinity DataIC50: 2.33E+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 83950BDBM83950(SMR000550708 | 2-chloranyl-3-(2-morpholin-4-ylethy...)
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