BDBM50067816 9-(3-Bromo-phenyl)-7-ethyl-6,7,8,9-tetrahydro-5H-10-thia-7-aza-benzo[a]azulene::CHEMBL139081

SMILES CCN1CCc2c(sc3ccccc23)C(C1)c1cccc(Br)c1

InChI Key InChIKey=AZJLNNJMUCJPAO-UHFFFAOYSA-N

Data  7 IC50

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   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50067816   

TargetSodium-dependent dopamine transporter(Rattus norvegicus (rat))
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM50067816(9-(3-Bromo-phenyl)-7-ethyl-6,7,8,9-tetrahydro-5H-1...)
Show SMILES CCN1CCc2c(sc3ccccc23)C(C1)c1cccc(Br)c1
Show InChI InChI=1S/C20H20BrNS/c1-2-22-11-10-17-16-8-3-4-9-19(16)23-20(17)18(13-22)14-6-5-7-15(21)12-14/h3-9,12,18H,2,10-11,13H2,1H3
Affinity DataIC50: 210nMAssay Description:relative affinity against dopamine transporter using WIN-35428 as radioligandMore data for this Ligand-Target Pair
TargetSodium-dependent serotonin transporter(Rattus norvegicus (rat))
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM50067816(9-(3-Bromo-phenyl)-7-ethyl-6,7,8,9-tetrahydro-5H-1...)
Show SMILES CCN1CCc2c(sc3ccccc23)C(C1)c1cccc(Br)c1
Show InChI InChI=1S/C20H20BrNS/c1-2-22-11-10-17-16-8-3-4-9-19(16)23-20(17)18(13-22)14-6-5-7-15(21)12-14/h3-9,12,18H,2,10-11,13H2,1H3
Affinity DataIC50: 4.30E+3nMAssay Description:relative affinity against serotonin transporter using RTI-55 as radioligandMore data for this Ligand-Target Pair
TargetKappa-type opioid receptor(Rattus norvegicus (rat))
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM50067816(9-(3-Bromo-phenyl)-7-ethyl-6,7,8,9-tetrahydro-5H-1...)
Show SMILES CCN1CCc2c(sc3ccccc23)C(C1)c1cccc(Br)c1
Show InChI InChI=1S/C20H20BrNS/c1-2-22-11-10-17-16-8-3-4-9-19(16)23-20(17)18(13-22)14-6-5-7-15(21)12-14/h3-9,12,18H,2,10-11,13H2,1H3
Affinity DataIC50: 1.25E+4nMAssay Description:relative affinity against Opioid receptor kappa 1 in insular Ctx using [3H]U-69593 as radioligandMore data for this Ligand-Target Pair
TargetD(3) dopamine receptor(Rattus norvegicus (Rat))
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM50067816(9-(3-Bromo-phenyl)-7-ethyl-6,7,8,9-tetrahydro-5H-1...)
Show SMILES CCN1CCc2c(sc3ccccc23)C(C1)c1cccc(Br)c1
Show InChI InChI=1S/C20H20BrNS/c1-2-22-11-10-17-16-8-3-4-9-19(16)23-20(17)18(13-22)14-6-5-7-15(21)12-14/h3-9,12,18H,2,10-11,13H2,1H3
Affinity DataIC50: 2.00E+3nMAssay Description:relative affinity against Dopamine receptor D3 in ventral striatum using [3H](+)-7-OH-DPAT as radioligandMore data for this Ligand-Target Pair
TargetD(1A) dopamine receptor(RAT)
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM50067816(9-(3-Bromo-phenyl)-7-ethyl-6,7,8,9-tetrahydro-5H-1...)
Show SMILES CCN1CCc2c(sc3ccccc23)C(C1)c1cccc(Br)c1
Show InChI InChI=1S/C20H20BrNS/c1-2-22-11-10-17-16-8-3-4-9-19(16)23-20(17)18(13-22)14-6-5-7-15(21)12-14/h3-9,12,18H,2,10-11,13H2,1H3
Affinity DataIC50: 5.00E+3nMAssay Description:Relative affinity for Dopamine receptor D1 in striatum using [3H]SCH-23390More data for this Ligand-Target Pair
TargetMu-type opioid receptor(Rattus norvegicus (rat))
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM50067816(9-(3-Bromo-phenyl)-7-ethyl-6,7,8,9-tetrahydro-5H-1...)
Show SMILES CCN1CCc2c(sc3ccccc23)C(C1)c1cccc(Br)c1
Show InChI InChI=1S/C20H20BrNS/c1-2-22-11-10-17-16-8-3-4-9-19(16)23-20(17)18(13-22)14-6-5-7-15(21)12-14/h3-9,12,18H,2,10-11,13H2,1H3
Affinity DataIC50: 5.00E+3nMAssay Description:Relative affinity against Opioid receptor mu 1 in thalamus using [3H]DAMGO as radioligandMore data for this Ligand-Target Pair
TargetD(2) dopamine receptor(Rattus norvegicus (rat))
University of Minnesota

Curated by ChEMBL
LigandPNGBDBM50067816(9-(3-Bromo-phenyl)-7-ethyl-6,7,8,9-tetrahydro-5H-1...)
Show SMILES CCN1CCc2c(sc3ccccc23)C(C1)c1cccc(Br)c1
Show InChI InChI=1S/C20H20BrNS/c1-2-22-11-10-17-16-8-3-4-9-19(16)23-20(17)18(13-22)14-6-5-7-15(21)12-14/h3-9,12,18H,2,10-11,13H2,1H3
Affinity DataIC50: 3.50E+3nMAssay Description:relative affinity against Dopamine receptor D2 in striatum using [3H]YM-09151-2 as radioligandMore data for this Ligand-Target Pair