BDBM485796 (R)-N-methyl-3-(quinolin- 3-yloxy)-3-(thiophen-2- yl)propan-1-amine::US10941138, Example 94

SMILES CNCC[C@@H](Oc1cnc2ccccc2c1)c1cccs1

InChI Key InChIKey=VLNOXQMNAQVFAB-UHFFFAOYSA-N

Data  3 KI

  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 = 485796   

TargetNeuroepithelial cell-transforming gene 1 protein(Human)
Esteve Pharmaceuticals

US Patent
LigandPNGBDBM485796((R)-N-methyl-3-(quinolin- 3-yloxy)-3-(thiophen-2- ...)
Affinity DataKi:  300nMAssay Description:Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer contain...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/20/2021
Entry Details
US Patent

TargetVoltage-dependent calcium channel subunit alpha-2/delta-1(Human)
Esteve Pharmaceuticals

US Patent
LigandPNGBDBM485796((R)-N-methyl-3-(quinolin- 3-yloxy)-3-(thiophen-2- ...)
Affinity DataKi: >3.00E+3nMAssay Description:Human α2δ-1 enriched membranes (2.5 μg) were incubated with 15 nM of radiolabeled [3H]-Gabapentin in assay buffer containing Hepes-KOH...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/20/2021
Entry Details
US Patent

TargetVoltage-dependent calcium channel subunit alpha-2/delta-1(Human)
Esteve Pharmaceuticals

US Patent
LigandPNGBDBM485796((R)-N-methyl-3-(quinolin- 3-yloxy)-3-(thiophen-2- ...)
Affinity DataKi: >3.00E+3nMAssay Description:Human α2δ-1 enriched membranes (2.5 μg) were incubated with 15 nM of radiolabeled [3H]-Gabapentin in assay buffer containing Hepes-KOH...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/20/2021
Entry Details
US Patent