BDBM50210640 (1R)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methylpiperazin-1-yl)ethyl)-1,3,7,7a-tetrahydroisobenzofuran-5-carboxamide::CHEMBL392780

SMILES C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(ccc12)C#N

InChI Key InChIKey=RNYOAQVTXKPTQL-UHFFFAOYSA-N

Data  4 KI

  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 4 hits for monomerid = 50210640   

TargetSodium-dependent serotonin transporter(Human)
Eli Lilly

Curated by ChEMBL
LigandPNGBDBM50210640((1R)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methyl...)
Affinity DataKi:  1.30nMAssay Description:Displacement of [3H]citalopram from human 5HT transporter expressed in HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1D(Human)
Eli Lilly

Curated by ChEMBL
LigandPNGBDBM50210640((1R)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methyl...)
Affinity DataKi:  1.80nMAssay Description:Displacement of [3H]GR-125743 from human 5HT1D expressed in LM(tk-) cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1B(Human)
Eli Lilly

Curated by ChEMBL
LigandPNGBDBM50210640((1R)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methyl...)
Affinity DataKi:  88nMAssay Description:Displacement of [3H]GR-125743 from human 5HT1B expressed in LM(tk-) cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Rat)
Eli Lilly

Curated by ChEMBL
LigandPNGBDBM50210640((1R)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methyl...)
Affinity DataKi:  346nMAssay Description:Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed