BDBM422806 US10508107, Example 12

SMILES Clc1ccc(nc1)C(=O)Nc1ccc(cc1)[C@H]1CNCCO1

InChI Key InChIKey=ASRMZZJJYSITLY-UHFFFAOYSA-N

Data  1 KI  1 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 422806   

TargetTrace amine-associated receptor 1(Human)
Hoffmann-La Roche

US Patent
LigandPNGBDBM422806(US10508107, Example 12)
Affinity DataEC50:  212nMAssay Description:For the construction of expression plasmids the coding sequences of human TAAR 1 were amplified from genomic DNA essentially as described by Lindeman...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/12/2020
Entry Details
US Patent

TargetSodium-dependent dopamine transporter(Human)
Hoffmann-La Roche

US Patent
LigandPNGBDBM422806(US10508107, Example 12)
Affinity DataKi:  1.78E+3nMAssay Description:Binding to dopamine transporter (DAT) in vitro. Human embryonic kidney (HEK) 293 cells (Invitrogen, Zug, Switzerland) stably transfected with human D...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/12/2020
Entry Details
US Patent

TargetPotassium voltage-gated channel subfamily H member 2(Human)
Hoffmann-La Roche

US Patent
LigandPNGBDBM422806(US10508107, Example 12)
Affinity DataIC50: 1.43E+4nMAssay Description:The whole-cell patch-clamp technique was used to investigate the effects of the test items on hERG (human-ether-a-go-go related gene) potassium chann...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/12/2020
Entry Details
US Patent