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BDBM26929 8-[(2,6-dichlorophenyl)methyl]-1-phenyl-3-[2-(pyrrolidin-1-yl)ethyl]-1,3,8-triazaspiro[4.5]decan-4-one::spiropiperidine analogue, 50

SMILES: Clc1cccc(Cl)c1CN1CCC2(CC1)N(CN(CCN1CCCC1)C2=O)c1ccccc1

InChI Key: InChIKey=PAUCBEYUHQSRSV-UHFFFAOYSA-N

Data: 4 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 26929   
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))
BDBM26929
PNG
(8-[(2,6-dichlorophenyl)methyl]-1-phenyl-3-[2-(pyrr...)
Show SMILES Clc1cccc(Cl)c1CN1CCC2(CC1)N(CN(CCN1CCCC1)C2=O)c1ccccc1
Show InChI InChI=1S/C26H32Cl2N4O/c27-23-9-6-10-24(28)22(23)19-30-15-11-26(12-16-30)25(33)31(18-17-29-13-4-5-14-29)20-32(26)21-7-2-1-3-8-21/h1-3,6-10H,4-5,11-20H2
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Article
PubMed
2.30n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute



Assay Description
IC50 values were obtained by fitting the competition binding curves according to a 4-parameter logistic model. Inhibition constants Ki were derived f...


Bioorg Med Chem Lett 19: 1164-7 (2009)


Article DOI: 10.1016/j.bmcl.2008.12.092
BindingDB Entry DOI: 10.7270/Q2TT4P95
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM26929
PNG
(8-[(2,6-dichlorophenyl)methyl]-1-phenyl-3-[2-(pyrr...)
Show SMILES Clc1cccc(Cl)c1CN1CCC2(CC1)N(CN(CCN1CCCC1)C2=O)c1ccccc1
Show InChI InChI=1S/C26H32Cl2N4O/c27-23-9-6-10-24(28)22(23)19-30-15-11-26(12-16-30)25(33)31(18-17-29-13-4-5-14-29)20-32(26)21-7-2-1-3-8-21/h1-3,6-10H,4-5,11-20H2
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15n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute



Assay Description
IC50 values were obtained by fitting the competition binding curves according to a 4-parameter logistic model. Inhibition constants Ki were derived f...


Bioorg Med Chem Lett 19: 1164-7 (2009)


Article DOI: 10.1016/j.bmcl.2008.12.092
BindingDB Entry DOI: 10.7270/Q2TT4P95
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM26929
PNG
(8-[(2,6-dichlorophenyl)methyl]-1-phenyl-3-[2-(pyrr...)
Show SMILES Clc1cccc(Cl)c1CN1CCC2(CC1)N(CN(CCN1CCCC1)C2=O)c1ccccc1
Show InChI InChI=1S/C26H32Cl2N4O/c27-23-9-6-10-24(28)22(23)19-30-15-11-26(12-16-30)25(33)31(18-17-29-13-4-5-14-29)20-32(26)21-7-2-1-3-8-21/h1-3,6-10H,4-5,11-20H2
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PubMed
37n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute



Assay Description
IC50 values were obtained by fitting the competition binding curves according to a 4-parameter logistic model. Inhibition constants Ki were derived f...


Bioorg Med Chem Lett 19: 1164-7 (2009)


Article DOI: 10.1016/j.bmcl.2008.12.092
BindingDB Entry DOI: 10.7270/Q2TT4P95
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM26929
PNG
(8-[(2,6-dichlorophenyl)methyl]-1-phenyl-3-[2-(pyrr...)
Show SMILES Clc1cccc(Cl)c1CN1CCC2(CC1)N(CN(CCN1CCCC1)C2=O)c1ccccc1
Show InChI InChI=1S/C26H32Cl2N4O/c27-23-9-6-10-24(28)22(23)19-30-15-11-26(12-16-30)25(33)31(18-17-29-13-4-5-14-29)20-32(26)21-7-2-1-3-8-21/h1-3,6-10H,4-5,11-20H2
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Article
PubMed
538n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute



Assay Description
IC50 values were obtained by fitting the competition binding curves according to a 4-parameter logistic model. Inhibition constants Ki were derived f...


Bioorg Med Chem Lett 19: 1164-7 (2009)


Article DOI: 10.1016/j.bmcl.2008.12.092
BindingDB Entry DOI: 10.7270/Q2TT4P95
More data for this
Ligand-Target Pair