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BDBM50185786 3-(1-(1,2-dihydroacenaphthylen-1-yl)-1,2,3,6-tetrahydropyridin-4-yl)-6-fluoro-1H-indole::CHEMBL209399

SMILES: Fc1ccc2c(c[nH]c2c1)C1=CCN(CC1)C1Cc2cccc3cccc1c23

InChI Key: InChIKey=OXZFNGHFFSZQER-UHFFFAOYSA-N

Data: 4 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50185786   
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))
BDBM50185786
PNG
(3-(1-(1,2-dihydroacenaphthylen-1-yl)-1,2,3,6-tetra...)
Show SMILES Fc1ccc2c(c[nH]c2c1)C1=CCN(CC1)C1Cc2cccc3cccc1c23 |t:12|
Show InChI InChI=1S/C25H21FN2/c26-19-7-8-20-22(15-27-23(20)14-19)16-9-11-28(12-10-16)24-13-18-5-1-3-17-4-2-6-21(24)25(17)18/h1-9,14-15,24,27H,10-13H2
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Article
PubMed
160n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at ORL1 receptor expressed in HEK293 cells by calciun flux assay


Bioorg Med Chem Lett 16: 3524-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.094
BindingDB Entry DOI: 10.7270/Q2VT1RQJ
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50185786
PNG
(3-(1-(1,2-dihydroacenaphthylen-1-yl)-1,2,3,6-tetra...)
Show SMILES Fc1ccc2c(c[nH]c2c1)C1=CCN(CC1)C1Cc2cccc3cccc1c23 |t:12|
Show InChI InChI=1S/C25H21FN2/c26-19-7-8-20-22(15-27-23(20)14-19)16-9-11-28(12-10-16)24-13-18-5-1-3-17-4-2-6-21(24)25(17)18/h1-9,14-15,24,27H,10-13H2
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Article
PubMed
>5.00E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 3524-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.094
BindingDB Entry DOI: 10.7270/Q2VT1RQJ
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50185786
PNG
(3-(1-(1,2-dihydroacenaphthylen-1-yl)-1,2,3,6-tetra...)
Show SMILES Fc1ccc2c(c[nH]c2c1)C1=CCN(CC1)C1Cc2cccc3cccc1c23 |t:12|
Show InChI InChI=1S/C25H21FN2/c26-19-7-8-20-22(15-27-23(20)14-19)16-9-11-28(12-10-16)24-13-18-5-1-3-17-4-2-6-21(24)25(17)18/h1-9,14-15,24,27H,10-13H2
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Article
PubMed
>5.00E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]DDPDE from delta opioid receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 3524-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.094
BindingDB Entry DOI: 10.7270/Q2VT1RQJ
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50185786
PNG
(3-(1-(1,2-dihydroacenaphthylen-1-yl)-1,2,3,6-tetra...)
Show SMILES Fc1ccc2c(c[nH]c2c1)C1=CCN(CC1)C1Cc2cccc3cccc1c23 |t:12|
Show InChI InChI=1S/C25H21FN2/c26-19-7-8-20-22(15-27-23(20)14-19)16-9-11-28(12-10-16)24-13-18-5-1-3-17-4-2-6-21(24)25(17)18/h1-9,14-15,24,27H,10-13H2
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Article
PubMed
>5.00E+3n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from kappa opioid receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 3524-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.094
BindingDB Entry DOI: 10.7270/Q2VT1RQJ
More data for this
Ligand-Target Pair