BDBM50146360 CHEMBL328573::Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12b-aza-dibenzo[e,h]azulen-2-yl)methyl]-amine

SMILES CN(C)C[C@@H]1C[C@H]2N(O1)c1ccccc1Cc1ccccc21

InChI Key InChIKey=BTSCZNWXJQSJIE-UHFFFAOYSA-N

Data  3 KI  38 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 41 hits for monomerid = 50146360   

TargetD(4) dopamine receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 132nMAssay Description:Binding affinity for human cloned Dopamine receptor D4More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetAlpha-2A adrenergic receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 372nMAssay Description:Binding affinity for human cloned Alpha-2A adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1D(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 661nMAssay Description:Binding affinity for human cloned 5-hydroxytryptamine 1D receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1D(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 661nMAssay Description:Binding affinity for human cloned 5-hydroxytryptamine 1D receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetAlpha-1A adrenergic receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 537nMAssay Description:Binding affinity for human cloned Alpha-1A adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 1.00E+3nMAssay Description:Binding affinity for human cloned 5-hydroxytryptamine 2A receptor expressed in L929 cells using [125I]R91150 as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 871nMAssay Description:Binding affinity for human cloned Dopamine receptor D2LMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 1.00E+3nMAssay Description:Binding affinity for human cloned Histamine H1 receptor expressed in CHO cells using [3H]pyrilamine as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 170nMAssay Description:Binding affinity for human cloned Dopamine receptor D3More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 1.00E+3nMAssay Description:Binding affinity for human cloned 5-hydroxytryptamine 2C receptor expressed in CHO cells using [3H]mesulergine as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 977nMAssay Description:Binding affinity for human cloned 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 23nMAssay Description:Binding affinity for human cloned 5-HT2A receptor expressed in L929 cells using [125I]R91150 as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetAlpha-2A adrenergic receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 372nMAssay Description:Binding affinity for human cloned Alpha-2A adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Rat)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 195nMAssay Description:Binding affinity for rat Dopamine receptor D2More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetAlpha-2C adrenergic receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 1.86E+3nMAssay Description:Binding affinity for human cloned Alpha-2C adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetAlpha-2C adrenergic receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 1.86E+3nMAssay Description:Binding affinity for human cloned Alpha-2C adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 12nMAssay Description:Binding affinity at human cloned 5-hydroxytryptamine 2C receptor expressed in CHO cells by [3H]mesulergine displacement.More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Rat)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 195nMAssay Description:Binding affinity for rat Dopamine receptor D2More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 871nMAssay Description:Binding affinity for human cloned Dopamine receptor D2LMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 6.80nMAssay Description:Binding affinity at human cloned Histamine H1 receptor expressed in CHO cells by [3H]pyrilamine displacement.More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetD(4) dopamine receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 132nMAssay Description:Binding affinity for human cloned Dopamine receptor D4More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 977nMAssay Description:Binding affinity for human cloned 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 6.80nMAssay Description:Binding affinity for human cloned Histamine H1 receptor expressed in CHO cells using [3H]pyrilamine as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 23nMAssay Description:Binding affinity for human cloned 5-hydroxytryptamine 2A receptor expressed in L929 cells using [125I]R91150 as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 12nMAssay Description:Binding affinity for human cloned 5-hydroxytryptamine 2C receptor expressed in CHO cells using [3H]mesulergine as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetAlpha-1A adrenergic receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 537nMAssay Description:Binding affinity against Alpha-1A adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
TargetAlpha-2A adrenergic receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 372nMAssay Description:Binding affinity against Alpha-2A adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1D(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 661nMAssay Description:Binding affinity against 5-HT1D receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 871nMAssay Description:Binding affinity against Dopamine receptor D2LMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 977nMAssay Description:Binding affinity against 5-HT1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
TargetBeta-3 adrenergic receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 1.86E+3nMAssay Description:Binding affinity against Alpha-3A adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 170nMAssay Description:Binding affinity against Dopamine receptor D3More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 6.80nMAssay Description:Binding affinity against Histamine H1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 12nMAssay Description:Binding affinity against 5-HT2C receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
TargetD(4) dopamine receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 132nMAssay Description:Binding affinity against Dopamine receptor D4More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 23nMAssay Description:Binding affinity against 5-hydroxytryptamine 2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
TargetAlpha-1A adrenergic receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 537nMAssay Description:Binding affinity for human cloned Alpha-1A adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataIC50: 170nMAssay Description:Binding affinity for human cloned Dopamine receptor D3More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/19/2013
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataKi:  0.640nMAssay Description:Ability to displace [3H]pyrilamine from human cloned histamine H1 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataKi:  1nMAssay Description:Ability to displace [3H]- mesulergine from human cloned 5-hydroxytryptamine 2C receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Janssen-Cilag

Curated by ChEMBL
LigandPNGBDBM50146360(Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12...)
Affinity DataKi:  2.5nMAssay Description:Ability to displace [125I]R91150 from human cloned 5-hydroxytryptamine 2A receptor expressed in L929 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed