BDBM50154716 (-)-1-Methyl-4-(8-methylsulfanyl-10,11-dihydro-dibenzo[b,f]thiepin-10-yl)-piperazine::1-Methyl-4-((S)-8-methylsulfanyl-10,11-dihydro-dibenzo[b,f]thiepin-10-yl)-piperazine::CHEMBL428892

SMILES CN1CCN(CC1)[C@H]2Cc3ccccc3Sc4c2cc(cc4)SC

InChI Key InChIKey=RLJFTICUTYVZDG-UHFFFAOYSA-N

Data  3 KI  3 IC50

PDB links: 2 PDB IDs match this monomer.

  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 6 hits for monomerid = 50154716   

Target5-hydroxytryptamine receptor 1A(Rat)
Merrell Dow Research Institute

Curated by ChEMBL
LigandPNGBDBM50154716(1-Methyl-4-((S)-8-methylsulfanyl-10,11-dihydro-dib...)
Affinity DataIC50: 95nMAssay Description:Binding affinity towards 5-hydroxytryptamine 1A receptor in rat frontal cortex using [3H]8-OH-DPAT as a radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1B(Rat)
Merrell Dow Research Institute

Curated by ChEMBL
LigandPNGBDBM50154716(1-Methyl-4-((S)-8-methylsulfanyl-10,11-dihydro-dib...)
Affinity DataIC50: 182nMAssay Description:Binding affinity towards 5-HT1B receptor in rat brain membrane using [3H]8-OH-DPAT as a selective ligand.More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
TargetSerotonin 2 (5-HT2) receptor(Rat)
Merrell Dow Research Institute

Curated by ChEMBL
LigandPNGBDBM50154716(1-Methyl-4-((S)-8-methylsulfanyl-10,11-dihydro-dib...)
Affinity DataIC50: 6.30nMAssay Description:Binding affinity towards 5-hydroxytryptamine 2 receptor in rat frontal cortex using [3H]ketanserin as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMedPDB3D3D Structure (crystal)
Target5-hydroxytryptamine receptor 7(Rat)
State University of Groningen

Curated by ChEMBL
LigandPNGBDBM50154716(1-Methyl-4-((S)-8-methylsulfanyl-10,11-dihydro-dib...)
Affinity DataKi:  1nMAssay Description:Binding affinity towards rat 5-HT7 receptor expressed in HEK cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 7(Rat)
State University of Groningen

Curated by ChEMBL
LigandPNGBDBM50154716(1-Methyl-4-((S)-8-methylsulfanyl-10,11-dihydro-dib...)
Affinity DataKi:  1nMAssay Description:Binding affinity towards 5-hydroxytryptamine 7 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 7(Human)
Universidad Complutense

Curated by ChEMBL
LigandPNGBDBM50154716(1-Methyl-4-((S)-8-methylsulfanyl-10,11-dihydro-dib...)
Affinity DataKi:  1nMAssay Description:Non-selective inhibitory activity was determined against 5-hydroxytryptamine 7 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/22/2020
Entry Details Article
PubMed