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SMILES: CN(CCOCCCc1ccccc1)Cc1ccccc1

InChI Key: InChIKey=HHMSWMRBJQRNHE-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 3 hits for monomerid = 50386973   
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
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50386973
PNG
(CHEMBL2048968)
Show SMILES CN(CCOCCCc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C19H25NO/c1-20(17-19-11-6-3-7-12-19)14-16-21-15-8-13-18-9-4-2-5-10-18/h2-7,9-12H,8,13-17H2,1H3
PDB

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UniProtKB/SwissProt

B.MOAD
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
2.76E+3n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain homogenate after 1 hr by liquid scintillation counting


Bioorg Med Chem 20: 4556-63 (2012)


Article DOI: 10.1016/j.bmc.2012.05.006
BindingDB Entry DOI: 10.7270/Q2DJ5GPH
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Rattus norvegicus (rat))
BDBM50386973
PNG
(CHEMBL2048968)
Show SMILES CN(CCOCCCc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C19H25NO/c1-20(17-19-11-6-3-7-12-19)14-16-21-15-8-13-18-9-4-2-5-10-18/h2-7,9-12H,8,13-17H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in rat brain homogenate after 1 hr by liquid scintillation counting


Bioorg Med Chem 20: 4556-63 (2012)


Article DOI: 10.1016/j.bmc.2012.05.006
BindingDB Entry DOI: 10.7270/Q2DJ5GPH
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50386973
PNG
(CHEMBL2048968)
Show SMILES CN(CCOCCCc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C19H25NO/c1-20(17-19-11-6-3-7-12-19)14-16-21-15-8-13-18-9-4-2-5-10-18/h2-7,9-12H,8,13-17H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in rat brain homogenate after 1 hr by liquid scintillation counting


Bioorg Med Chem 20: 4556-63 (2012)


Article DOI: 10.1016/j.bmc.2012.05.006
BindingDB Entry DOI: 10.7270/Q2DJ5GPH
More data for this
Ligand-Target Pair