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BDBM50153128 1-(1-Cyclooctyl-piperidin-4-yl)-3,4-dihydro-1H-benzo[1,2,6]thiadiazine 2,2-dioxide::CHEMBL184451

SMILES: O=S1(=O)NCc2ccccc2N1C1CCN(CC1)C1CCCCCCC1

InChI Key: InChIKey=DSAFTNAGTDWVPT-UHFFFAOYSA-N

Data: 4 KI  1 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50153128   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Nociceptin receptor


(Homo sapiens (Human))
BDBM50153128
PNG
(1-(1-Cyclooctyl-piperidin-4-yl)-3,4-dihydro-1H-ben...)
Show SMILES O=S1(=O)NCc2ccccc2N1C1CCN(CC1)C1CCCCCCC1
Show InChI InChI=1S/C20H31N3O2S/c24-26(25)21-16-17-8-6-7-11-20(17)23(26)19-12-14-22(15-13-19)18-9-4-2-1-3-5-10-18/h6-8,11,18-19,21H,1-5,9-10,12-16H2
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Article
PubMed
187n/an/an/an/an/an/an/an/a



Purdue Pharma LP

Curated by ChEMBL


Assay Description
Inhibition of [3H]nociceptin binding to human Opioid receptor like 1


Bioorg Med Chem Lett 14: 5045-50 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.001
BindingDB Entry DOI: 10.7270/Q2TM7BV8
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50153128
PNG
(1-(1-Cyclooctyl-piperidin-4-yl)-3,4-dihydro-1H-ben...)
Show SMILES O=S1(=O)NCc2ccccc2N1C1CCN(CC1)C1CCCCCCC1
Show InChI InChI=1S/C20H31N3O2S/c24-26(25)21-16-17-8-6-7-11-20(17)23(26)19-12-14-22(15-13-19)18-9-4-2-1-3-5-10-18/h6-8,11,18-19,21H,1-5,9-10,12-16H2
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1.38E+3n/an/an/an/an/an/an/an/a



Purdue Pharma LP

Curated by ChEMBL


Assay Description
Inhibition of [3H]diprenorphine binding to human Opioid receptor mu 1


Bioorg Med Chem Lett 14: 5045-50 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.001
BindingDB Entry DOI: 10.7270/Q2TM7BV8
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50153128
PNG
(1-(1-Cyclooctyl-piperidin-4-yl)-3,4-dihydro-1H-ben...)
Show SMILES O=S1(=O)NCc2ccccc2N1C1CCN(CC1)C1CCCCCCC1
Show InChI InChI=1S/C20H31N3O2S/c24-26(25)21-16-17-8-6-7-11-20(17)23(26)19-12-14-22(15-13-19)18-9-4-2-1-3-5-10-18/h6-8,11,18-19,21H,1-5,9-10,12-16H2
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>2.00E+3n/an/an/an/an/an/an/an/a



Purdue Pharma LP

Curated by ChEMBL


Assay Description
Inhibition of [3H]U-69593 binding to human Opioid receptor kappa 1


Bioorg Med Chem Lett 14: 5045-50 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.001
BindingDB Entry DOI: 10.7270/Q2TM7BV8
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50153128
PNG
(1-(1-Cyclooctyl-piperidin-4-yl)-3,4-dihydro-1H-ben...)
Show SMILES O=S1(=O)NCc2ccccc2N1C1CCN(CC1)C1CCCCCCC1
Show InChI InChI=1S/C20H31N3O2S/c24-26(25)21-16-17-8-6-7-11-20(17)23(26)19-12-14-22(15-13-19)18-9-4-2-1-3-5-10-18/h6-8,11,18-19,21H,1-5,9-10,12-16H2
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>2.00E+3n/an/an/an/an/an/an/an/a



Purdue Pharma LP

Curated by ChEMBL


Assay Description
Inhibition of [3H]naltrindole binding to human Opioid receptor delta 1


Bioorg Med Chem Lett 14: 5045-50 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.001
BindingDB Entry DOI: 10.7270/Q2TM7BV8
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50153128
PNG
(1-(1-Cyclooctyl-piperidin-4-yl)-3,4-dihydro-1H-ben...)
Show SMILES O=S1(=O)NCc2ccccc2N1C1CCN(CC1)C1CCCCCCC1
Show InChI InChI=1S/C20H31N3O2S/c24-26(25)21-16-17-8-6-7-11-20(17)23(26)19-12-14-22(15-13-19)18-9-4-2-1-3-5-10-18/h6-8,11,18-19,21H,1-5,9-10,12-16H2
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Article
PubMed
n/an/an/an/a 2.01E+3n/an/an/an/a



Purdue Pharma LP

Curated by ChEMBL


Assay Description
Agonist activity as stimulation of [35S]-GTP-gamma binding to human Opioid receptor like 1


Bioorg Med Chem Lett 14: 5045-50 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.001
BindingDB Entry DOI: 10.7270/Q2TM7BV8
More data for this
Ligand-Target Pair