BDBM50035471 2-(3,4-Dichloro-phenyl)-N-[(S)-1-(3-isothiocyanato-phenyl)-2-pyrrolidin-1-yl-ethyl]-N-methyl-acetamide::CHEMBL38521

SMILES CN([C@H](CN1CCCC1)c1cccc(c1)N=C=S)C(=O)Cc1ccc(Cl)c(Cl)c1

InChI Key InChIKey=BNAKCEFXXMHXDQ-OAQYLSRUSA-N

Data  6 IC50  1 Kd

  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 7 hits for monomerid = 50035471   

TargetDelta-type opioid receptor(Homo sapiens (Human))
University Of Minnesota

Curated by ChEMBL
LigandPNGBDBM50035471(2-(3,4-Dichloro-phenyl)-N-[(S)-1-(3-isothiocyanato...)
Affinity DataIC50: >1.00E+3nMAssay Description:Binding affinity for delta opioid receptor in guinea pig brain membranes, using 2 nM [3H]-DPDPE as radioligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetKappa-type opioid receptor(Cavia porcellus (domestic guinea pig))
University Of Minnesota

Curated by ChEMBL
LigandPNGBDBM50035471(2-(3,4-Dichloro-phenyl)-N-[(S)-1-(3-isothiocyanato...)
Affinity DataKd:  2.40nMAssay Description:Tested for competitive covalent binding of compound against k opioid receptor in guinea pig brain membrane using [3H]-U-69,593 as radioligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMu-type opioid receptor(GUINEA PIG)
University Of Minnesota

Curated by ChEMBL
LigandPNGBDBM50035471(2-(3,4-Dichloro-phenyl)-N-[(S)-1-(3-isothiocyanato...)
Affinity DataIC50:  1.80E+3nMAssay Description:Binding affinity for mu opioid receptor in guinea pig brain membranes, using 2 nM [3H]-DAMGO as radioligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMu-type opioid receptor(GUINEA PIG)
University Of Minnesota

Curated by ChEMBL
LigandPNGBDBM50035471(2-(3,4-Dichloro-phenyl)-N-[(S)-1-(3-isothiocyanato...)
Affinity DataIC50:  1.80E+3nMAssay Description:Binding affinity of compound towards mu receptor by using radioligand [3H]-DAMG0 on guinea pig brain membranesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDelta-type opioid receptor(Homo sapiens (Human))
University Of Minnesota

Curated by ChEMBL
LigandPNGBDBM50035471(2-(3,4-Dichloro-phenyl)-N-[(S)-1-(3-isothiocyanato...)
Affinity DataIC50: >1.00E+3nMAssay Description:Binding affinity of compound towards delta receptor by using radioligand [SHIDPDPE on guinea pig brain membranesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetKappa-type opioid receptor(Cavia porcellus (domestic guinea pig))
University Of Minnesota

Curated by ChEMBL
LigandPNGBDBM50035471(2-(3,4-Dichloro-phenyl)-N-[(S)-1-(3-isothiocyanato...)
Affinity DataIC50:  2.20nMAssay Description:Binding affinity of compound towards kappa receptor by using radioligand [3H]-U-69,593 on guinea pig brain membranesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetKappa-type opioid receptor(Cavia porcellus (domestic guinea pig))
University Of Minnesota

Curated by ChEMBL
LigandPNGBDBM50035471(2-(3,4-Dichloro-phenyl)-N-[(S)-1-(3-isothiocyanato...)
Affinity DataIC50:  2.20nMAssay Description:Binding affinity kappa opioid receptor in guinea pig brain membranes, using 1 nM [3H]-U69,593 as radioligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed