BDBM21425 4-Piperidinebenzylidene derivative, 10d::4-{4-[(4-chlorophenyl)methylidene]piperidin-1-yl}-N-[(4-{[(2R)-4-(dimethylamino)-1-(phenylsulfanyl)butan-2-yl]amino}-3-nitrobenzene)sulfonyl]benzamide

SMILES CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCC(=Cc4ccc(Cl)cc4)CC3)cc2)cc1[N+](=O)[O-]

InChI Key InChIKey=GNKCTPGOIDCXCZ-UHFFFAOYSA-N

Data  2 KI  1 IC50  3 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 21425   

TargetBcl-2-like protein 1(Human)
Abbott Laboratories

LigandChemical structure of BindingDB Monomer ID 21425BDBM21425(4-{4-[(4-chlorophenyl)methylidene]piperidin-1-yl}-...)
Affinity DataKi: <0.5nM ΔG°: <-12.7kcal/mole IC50: 510nM EC50:  620nMpH: 7.4 T: 2°CAssay Description:The binding affinities (Ki) of compounds were determined using fluorescence polarization assays (FPA) that measure their ability to competitively dis...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2008
Entry Details Article
PubMed
TargetApoptosis regulator Bcl-2(Human)
Abbott Laboratories

LigandChemical structure of BindingDB Monomer ID 21425BDBM21425(4-{4-[(4-chlorophenyl)methylidene]piperidin-1-yl}-...)
Affinity DataKi:  2.10nM EC50:  1.18E+3nMAssay Description:The binding affinities (Ki) of compounds were determined using fluorescence polarization assays (FPA) that measure their ability to competitively dis...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2008
Entry Details Article
PubMed
TargetBcl-2-like protein 1(Human)
Abbott Laboratories

LigandChemical structure of BindingDB Monomer ID 21425BDBM21425(4-{4-[(4-chlorophenyl)methylidene]piperidin-1-yl}-...)
Affinity DataEC50:  619nMAssay Description:Inhibition of Bcl-XLMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/22/2013
Entry Details Article
PubMed