null

SMILES COc1ccc(cc1OC)[C@H](Cc1c(Cl)c[n+]([O-])cc1Cl)OC(=O)c1ccc(CNC(C(=O)OC[C@H]2CN3CCC2CC3)c2ccccc2)s1

InChI Key InChIKey=CPBWZGQVJWDZGQ-GEYMQNLTSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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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 = 325621   

TargetMuscarinic acetylcholine receptor M3(Homo sapiens (Human))TBA
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataKi:  6.30nMAssay Description:Displacement of [3H]-N-methyl Scopolamine Chloride from human M3 receptor membranes incubated for 2 hrs by scintillation counting analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2DN48WCPubMed
TargetMuscarinic acetylcholine receptor M3(Homo sapiens (Human))TBA
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataKi:  6.31nMAssay Description:Displacement of [3H]-N-methyl Scopolamine Chloride from human M3 receptor membranes incubated for 2 hrs by scintillation counting analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2DN48WCPubMed
TargetMuscarinic acetylcholine receptor M3(Homo sapiens (Human))TBA
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataIC50: 55nMAssay Description:Human M3 receptor membranes (15 μg/well) from Perkin Elmer are incubated with 0.52 nM Scopolamine Methyl Chloride, [N-methyl-3H] with or without...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2JS9SH5US Patent
TargetIsoform PDE4B2 of cAMP-specific 3',5'-cyclic phosphodiesterase 4B (PDE4B2)(Homo sapiens (Human))
CHIESI FARMACEUTICI S.p.A.

US Patent
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataIC50: 5.5nMAssay Description:PDE4B2 activity is detected using the LANCE Ultra cAMP homogeneous time resolved fluorescence resonance energy transfer (TR-FRET) assay from Perkin E...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2JS9SH5US Patent
TargetMuscarinic acetylcholine receptor M3(Homo sapiens (Human))TBA
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataIC50: 5.5nMAssay Description:Human M3 receptor membranes (15 μg/well) from Perkin Elmer are incubated with 0.52 nM Scopolamine Methyl Chloride, [N-methyl-3H] with or without...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2JS9SH5US Patent
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataIC50: 2nMAssay Description:Inhibition of human recombinant PDE4B2 assessed as reduction in cAMP level incubated for 2 hrs by LANCE Ultra cAMP TR-FRET assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2DN48WCPubMed
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataIC50: 2nMAssay Description:Inhibition of human recombinant PDE4B2 assessed as reduction in cAMP level incubated for 2 hrs by LANCE Ultra cAMP TR-FRET assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2DN48WCPubMed
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataIC50: 20nMAssay Description:Antagonist activity at muscarinic M3 receptor in rat trachea assessed as inhibition of carbachol-induced contractionMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2DN48WCPubMed
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataIC50: 20nMAssay Description:Antagonist activity at muscarinic M3 receptor in rat trachea assessed as inhibition of carbachol-induced contractionMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2DN48WCPubMed
TargetIsoform PDE4B2 of cAMP-specific 3',5'-cyclic phosphodiesterase 4B (PDE4B2)(Homo sapiens (Human))
CHIESI FARMACEUTICI S.p.A.

US Patent
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataIC50: 1nMAssay Description:PDE4B2 activity is detected using the LANCE Ultra cAMP homogeneous time resolved fluorescence resonance energy transfer (TR-FRET) assay from Perkin E...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2JS9SH5US Patent
TargetMuscarinic acetylcholine receptor M3(Homo sapiens (Human))TBA
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataIC50: 5.5nMAssay Description:Human M3 receptor membranes (15 μg/well) from Perkin Elmer are incubated with 0.52 nM Scopolamine Methyl Chloride, [N-methyl-3H] with or without...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2JS9SH5US Patent
TargetIsoform PDE4B2 of cAMP-specific 3',5'-cyclic phosphodiesterase 4B (PDE4B2)(Homo sapiens (Human))
CHIESI FARMACEUTICI S.p.A.

US Patent
LigandPNGBDBM325621(US9636336, Example 11 | US9636336, Example 65 | US...)copy SMILEScopy InChI
Affinity DataIC50: 5.5nMAssay Description:PDE4B2 activity is detected using the LANCE Ultra cAMP homogeneous time resolved fluorescence resonance energy transfer (TR-FRET) assay from Perkin E...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2JS9SH5US Patent