BDBM287139 1-(1-(2-(azepan- 1-yl)ethyl)-1H- pyrazolo[3,4- d]pyrimidin-4-yl)-3- cyclopropylthiourea hydrochloride::US9567338, 79

SMILES S=C(NC1CC1)Nc1ncnc2n(CCN3CCCCCC3)ncc12

InChI Key InChIKey=DEMSVRGWAKYHMI-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 = 287139   

TargetSigma non-opioid intracellular receptor 1(Guinea pig)
Laboratorios Del Dr. Esteve

US Patent
LigandPNGBDBM287139(1-(1-(2-(azepan- 1-yl)ethyl)-1H- pyrazolo[3,4- d]p...)
Affinity DataKi:  21.8nMpH: 7.4Assay Description:Brain membrane preparation and binding assays for the σ1-receptor were performed as described (DeHaven-Hudkins, D. L., L. C. Fleissner, and F. Y...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent