BDBM50175461 3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-methyl-5,6,7,8-tetrahydro-3H-pyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-one::CHEMBL370110

SMILES CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3cncc4ccccc34)c(=O)c21

InChI Key InChIKey=HIBUHKNMTZCDMF-UHFFFAOYSA-N

Data  10 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 50175461   

Target5-hydroxytryptamine receptor 1A(Human)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataIC50: 316nMAssay Description:Displacement of [35S]GTP-gamma-S from human recombinant 5HT1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1B(Human)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataIC50: 35nMAssay Description:Inhibitory activity against human recombinant 5HT1B receptor co-expressed with G-protein chimera Gqo5 in HEK293 cells by FLIPRMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Human)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataKi:  1.18nMAssay Description:Inhibitory activity against dopamine D3 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataKi:  1.20nMAssay Description:Inhibitory activity against dopamine D2(long) receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1B(Human)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataKi:  2.5nMAssay Description:Inhibitory activity against human recombinant 5HT1B receptor co-expressed with G-protein chimera Gqo5 in HEK293 cells by FLIPRMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataKi:  4.70nMAssay Description:Displacement of [35S]GTP-gamma-S from human recombinant 5HT1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 5A(Human)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataKi: >10nMAssay Description:Inhibitory activity against 5HT5A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataKi: >10nMAssay Description:Inhibitory activity against 5HT2C receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Rat)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataKi:  16.3nMAssay Description:Binding affinity for rat 5HT1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1B(Rat)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataKi:  33.1nMAssay Description:Binding affinity for rat 5HT1B receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataKi:  180nMAssay Description:Inhibitory activity against 5HT2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 7(Human)
Abbott

Curated by ChEMBL
LigandPNGBDBM50175461(3-[2-(4-isoquinolin-4-yl-piperazin-1-yl)-ethyl]-7-...)
Affinity DataKi:  520nMAssay Description:Inhibitory activity against 5HT7 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed