BDBM71487 MLS001111013::N-(2,2-dimethyl-4-oxanyl)-5-[(4-methoxy-1-naphthalenyl)oxymethyl]-3-isoxazolecarboxamide::N-(2,2-dimethyloxan-4-yl)-5-[(4-methoxynaphthalen-1-yl)oxymethyl]-1,2-oxazole-3-carboxamide::N-(2,2-dimethyltetrahydropyran-4-yl)-5-[(4-methoxy-1-naphthoxy)methyl]isoxazole-3-carboxamide::SMR000669883::cid_24817510

SMILES COc1ccc(OCc2cc(no2)C(=O)NC2CCOC(C)(C)C2)c2ccccc12

InChI Key InChIKey=LXHCRNLYOQJFHB-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 = 71487   

TargetCaspase-9(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 71487BDBM71487(SMR000669883 | cid_24817510 | MLS001111013 | N-(2,...)
Affinity DataIC50: 1.79E+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 71487BDBM71487(SMR000669883 | cid_24817510 | MLS001111013 | N-(2,...)
Affinity DataIC50: 2.61E+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
LigandChemical structure of BindingDB Monomer ID 71487BDBM71487(SMR000669883 | cid_24817510 | MLS001111013 | N-(2,...)
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