BDBM485710 3-(isoquinolin-1-yloxy)- N,N-dimethyl-3-(thiophen- 2-yl)propan-1-amine::US10941138, Example 8

SMILES CN(C)CCC(Oc1nccc2ccccc12)c1cccs1

InChI Key InChIKey=IKVUUSIZXDYEDC-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 485710   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 485710BDBM485710(3-(isoquinolin-1-yloxy)- N,N-dimethyl-3-(thiophen-...)
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