BDBM54748 3-hydroxy-6-(hydroxymethyl)-2-(pyridin-2-yl{[3-(trifluoromethyl)phenyl]amino}methyl)-4H-pyran-4-one::3-hydroxy-6-(hydroxymethyl)-2-[2-pyridinyl-[3-(trifluoromethyl)anilino]methyl]-4-pyranone::3-hydroxy-6-(hydroxymethyl)-2-[pyridin-2-yl-[3-(trifluoromethyl)anilino]methyl]pyran-4-one::3-hydroxy-6-methylol-2-[2-pyridyl-[3-(trifluoromethyl)anilino]methyl]pyran-4-one::6-(hydroxymethyl)-3-oxidanyl-2-[pyridin-2-yl-[[3-(trifluoromethyl)phenyl]amino]methyl]pyran-4-one::MLS000766783::SMR000339679::cid_4172393

SMILES OCc1cc(=O)c(O)c(o1)C(Nc1cccc(c1)C(F)(F)F)c1ccccn1

InChI Key InChIKey=QXXFYAVFYIHEBC-UHFFFAOYSA-N

Data  3 IC50

  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 = 54748   

TargetAmyloid-beta A4 precursor protein-binding family A member 1(Rat)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54748(6-(hydroxymethyl)-3-oxidanyl-2-[pyridin-2-yl-[[3-(...)
Affinity DataIC50: 1.09E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
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TargetVoltage-dependent N-type calcium channel subunit alpha-1B(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54748(6-(hydroxymethyl)-3-oxidanyl-2-[pyridin-2-yl-[[3-(...)
Affinity DataIC50: 8.71E+3nMAssay Description:Data Source: Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute Network...More data for this Ligand-Target Pair
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TargetUbiquitin-conjugating enzyme E2 N(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54748(6-(hydroxymethyl)-3-oxidanyl-2-[pyridin-2-yl-[[3-(...)
Affinity DataIC50: 2.00E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In DepthDetails
PCBioAssay