BDBM71078 2-chloranyl-3-(2-piperidin-1-ylethylamino)naphthalene-1,4-dione::2-chloro-3-(2-piperidin-1-ylethylamino)naphthalene-1,4-dione::2-chloro-3-(2-piperidinoethylamino)-1,4-naphthoquinone::2-chloro-3-[(2-piperidinoethyl)amino]naphthoquinone::2-chloro-3-[2-(1-piperidinyl)ethylamino]naphthalene-1,4-dione::MLS000755698::SMR000337375::cid_4679493

SMILES Oc1c(Cl)c(N=CCN2CCCCC2)c(O)c2ccccc12

InChI Key InChIKey=NLQDUHMBRDDLQS-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 71078   

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

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 71078BDBM71078(cid_4679493 | MLS000755698 | 2-chloranyl-3-(2-pipe...)
Affinity DataIC50: 5.40E+3nMAssay 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 71078BDBM71078(cid_4679493 | MLS000755698 | 2-chloranyl-3-(2-pipe...)
Affinity DataIC50: 6.08E+3nMAssay 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 71078BDBM71078(cid_4679493 | MLS000755698 | 2-chloranyl-3-(2-pipe...)
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