BDBM50203945 (S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-4-yl)pyrrolidin-3-amine::CHEMBL247733

SMILES Cc1cccc(CN([C@H]2CCNC2)C2CCOCC2)c1C

InChI Key InChIKey=BGSBHLAICAANSC-SFHVURJKSA-N

Data  1 KI  13 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 50203945   

TargetPotassium voltage-gated channel subfamily H member 2(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataKi: >7.50E+3nMAssay Description:Binding affinity to human ERGMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  5.90E+3nMAssay Description:Inhibition of human CYP2D6More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  727nMAssay Description:Inhibition of [3H]DA from human DAT expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  9nMAssay Description:Inhibition of [3H]5HT from human SERT expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  727nMAssay Description:Inhibition of [3H]DA reuptake at human dopamine transporter expressed in HEK293 cells by scintillation countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  9nMAssay Description:Inhibition of [3H]5HT reuptake at human serotonin transporter expressed in HEK293 cells by scintillation countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  9nMAssay Description:Inhibition of [3H]5-HT uptake at human recombinant 5HT transporter expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  9nMAssay Description:Inhibition of [3H]5HT uptake at human 5HT transporter expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent noradrenaline transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  7nMAssay Description:Inhibition of [3H]NA uptake at human NA transporter expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  727nMAssay Description:Inhibition of [3H]dopamine uptake at human dopamine transporter expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent noradrenaline transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  7nMAssay Description:Inhibition of [3H]NA uptake at human recombinant NA transporter expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent dopamine transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  727nMAssay Description:Inhibition of [3H]DA uptake at human recombinant DAT expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent noradrenaline transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  7nMAssay Description:Inhibition of [3H]NA from human NET expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSodium-dependent noradrenaline transporter(Homo sapiens (Human))
Pfizer

Curated by ChEMBL
LigandPNGBDBM50203945((S)-N-(2,3-dimethylbenzyl)-N-(tetrahydro-2H-pyran-...)
Affinity DataIC50:  7nMAssay Description:Inhibition of [3H]NA reuptake in human noradrenaline transporter expressed in HEK293 cells by scintillation countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed