BDBM50039750 CHEMBL93534::Trifluoro-methanesulfonic acid 3-allyl-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]indol-6-yl ester

SMILES FC(F)(F)S(=O)(=O)Oc1cccc2C3CCN(CC=C)C3CCc12

InChI Key InChIKey=JNAGEIMWCSOQKU-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50039750   

Target5-hydroxytryptamine receptor 1A(Rat)
University of G£Teborg

Curated by ChEMBL
LigandPNGBDBM50039750(Trifluoro-methanesulfonic acid 3-allyl-2,3,3a,4,5,...)
Affinity DataKi:  18nMAssay Description:Tested for affinity against 5-hydroxytryptamine 1A receptor using [3H]8-OH-DPAT in homogenized rat brain tissueMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/27/2012
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Human)
University of G£Teborg

Curated by ChEMBL
LigandPNGBDBM50039750(Trifluoro-methanesulfonic acid 3-allyl-2,3,3a,4,5,...)
Affinity DataKi:  67nMAssay Description:Tested for in vitro binding affinity against cloned mammalian dopamine autoreceptor (DA) receptors expressed in CHO-K1 cells [3H]-spiperone as radiol...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/27/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Rat)
University of G£Teborg

Curated by ChEMBL
LigandPNGBDBM50039750(Trifluoro-methanesulfonic acid 3-allyl-2,3,3a,4,5,...)
Affinity DataKi: >172nMAssay Description:Tested for affinity against striatal dopamine autoreceptor (DA) D2 receptors using [3H]spiperone as radioligand in rats.More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/27/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
University of G£Teborg

Curated by ChEMBL
LigandPNGBDBM50039750(Trifluoro-methanesulfonic acid 3-allyl-2,3,3a,4,5,...)
Affinity DataKi: >217nMAssay Description:Affinity against recombinant dopamine receptor (DA) D2 expressed in CHO-K1 cells, using [3H]-spiperone as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/27/2012
Entry Details Article
PubMed