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SMILES: Cc1ccccc1C(N1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccccc1C

InChI Key: InChIKey=KSPKRQXUKZRGJM-UHFFFAOYSA-N

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 = 50204791   
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))
BDBM50204791
PNG
(8-di-o-tolylmethyl-1-phenyl-1,3,8-triaza-spiro[4.5...)
Show SMILES Cc1ccccc1C(N1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccccc1C
Show InChI InChI=1S/C28H31N3O/c1-21-10-6-8-14-24(21)26(25-15-9-7-11-22(25)2)30-18-16-28(17-19-30)27(32)29-20-31(28)23-12-4-3-5-13-23/h3-15,26H,16-20H2,1-2H3,(H,29,32)
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Article
PubMed
9n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]nociceptin from human nociceptin receptor expressed in CHO cell membrane


Bioorg Med Chem Lett 17: 2281-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.069
BindingDB Entry DOI: 10.7270/Q2T43SRZ
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50204791
PNG
(8-di-o-tolylmethyl-1-phenyl-1,3,8-triaza-spiro[4.5...)
Show SMILES Cc1ccccc1C(N1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccccc1C
Show InChI InChI=1S/C28H31N3O/c1-21-10-6-8-14-24(21)26(25-15-9-7-11-22(25)2)30-18-16-28(17-19-30)27(32)29-20-31(28)23-12-4-3-5-13-23/h3-15,26H,16-20H2,1-2H3,(H,29,32)
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346n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human mu opioid receptor expressed in CHO cell membrane


Bioorg Med Chem Lett 17: 2281-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.069
BindingDB Entry DOI: 10.7270/Q2T43SRZ
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50204791
PNG
(8-di-o-tolylmethyl-1-phenyl-1,3,8-triaza-spiro[4.5...)
Show SMILES Cc1ccccc1C(N1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccccc1C
Show InChI InChI=1S/C28H31N3O/c1-21-10-6-8-14-24(21)26(25-15-9-7-11-22(25)2)30-18-16-28(17-19-30)27(32)29-20-31(28)23-12-4-3-5-13-23/h3-15,26H,16-20H2,1-2H3,(H,29,32)
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PubMed
1.60E+3n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human kappa opioid receptor expressed in CHO cell membrane


Bioorg Med Chem Lett 17: 2281-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.069
BindingDB Entry DOI: 10.7270/Q2T43SRZ
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50204791
PNG
(8-di-o-tolylmethyl-1-phenyl-1,3,8-triaza-spiro[4.5...)
Show SMILES Cc1ccccc1C(N1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccccc1C
Show InChI InChI=1S/C28H31N3O/c1-21-10-6-8-14-24(21)26(25-15-9-7-11-22(25)2)30-18-16-28(17-19-30)27(32)29-20-31(28)23-12-4-3-5-13-23/h3-15,26H,16-20H2,1-2H3,(H,29,32)
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Article
PubMed
8.60E+3n/an/an/an/an/an/an/an/a



Schering Plough Research Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from human delta opioid receptor expressed in CHO cell membrane


Bioorg Med Chem Lett 17: 2281-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.069
BindingDB Entry DOI: 10.7270/Q2T43SRZ
More data for this
Ligand-Target Pair