BDBM50314763 9-methyl-2-(methylthio)-3-(phenylsulfonyl)-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline::CHEMBL1092241::US8629154, 2(2)

SMILES CSc1nn2c(C)c3CCCCc3nc2c1S(=O)(=O)c1ccccc1

InChI Key InChIKey=WKNMEUSGOJIXHX-UHFFFAOYSA-N

Data  3 KI  4 IC50

  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 = 50314763   

Target5-hydroxytryptamine receptor 6(Homo sapiens (Human))
TBA

US Patent
LigandPNGBDBM50314763(9-methyl-2-(methylthio)-3-(phenylsulfonyl)-5,6,7,8...)
Affinity DataKi:  0.680nM ΔG°:  -12.7kcal/mole IC50:  1.46nMpH: 7.4 T: 2°CAssay Description:Determination of tested compounds binding with 5-HT6 receptors was carried out according to the method described in [Monsma F J Jr, Shen Y, Ward R P,...More data for this Ligand-Target Pair
In DepthDetails US Patent
Target5-hydroxytryptamine receptor 6(Homo sapiens (Human))
TBA

US Patent
LigandPNGBDBM50314763(9-methyl-2-(methylthio)-3-(phenylsulfonyl)-5,6,7,8...)
Affinity DataKi:  0.680nMAssay Description:Displacement of [3H]LSD from 5HT6 receptor in humanHeLa cells after 120 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target5-hydroxytryptamine receptor 6(Homo sapiens (Human))
TBA

US Patent
LigandPNGBDBM50314763(9-methyl-2-(methylthio)-3-(phenylsulfonyl)-5,6,7,8...)
Affinity DataKi:  0.680nMAssay Description:Antagonist activity at 5-HT6 receptor (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target5-hydroxytryptamine receptor 6(Homo sapiens (Human))
TBA

US Patent
LigandPNGBDBM50314763(9-methyl-2-(methylthio)-3-(phenylsulfonyl)-5,6,7,8...)
Affinity DataIC50:  7.80nMAssay Description:Antagonist activity at human 5HT6 receptor in HEK293 cells assessed as inhibition of serotonin-induced cAMP accumulation pretreated for 15 mins befor...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target5-hydroxytryptamine receptor 2B(Homo sapiens (Human))
Chemical Diversity Research Institute

Curated by ChEMBL
LigandPNGBDBM50314763(9-methyl-2-(methylthio)-3-(phenylsulfonyl)-5,6,7,8...)
Affinity DataIC50:  127nMAssay Description:Antagonist activity at human 5HT2B receptor in HEK293 cells assessed as inhibition of alphaME-5-HT-induced cAMP accumulation pretreated for 15 secs b...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target5-hydroxytryptamine receptor 6(Homo sapiens (Human))
TBA

US Patent
LigandPNGBDBM50314763(9-methyl-2-(methylthio)-3-(phenylsulfonyl)-5,6,7,8...)
Affinity DataIC50:  7.80nMAssay Description:Compounds of general formulas 1 and 2 were tested for their ability to prevent 5-HT6 receptors activation by serotonin. HEK 293 cells (cells of human...More data for this Ligand-Target Pair
In DepthDetails US Patent