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BDBM50213402 CHEMBL234807::ethyl 4-(1-(cyclohexylmethyl)-1H-imidazol-2-yl)-4-phenylpiperidine-1-carboxylate

SMILES: CCOC(=O)N1CCC(CC1)(c1nccn1CC1CCCCC1)c1ccccc1

InChI Key: InChIKey=PPAOBNVGWZASJZ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50213402   
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
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50213402
PNG
(CHEMBL234807 | ethyl 4-(1-(cyclohexylmethyl)-1H-im...)
Show SMILES CCOC(=O)N1CCC(CC1)(c1nccn1CC1CCCCC1)c1ccccc1
Show InChI InChI=1S/C24H33N3O2/c1-2-29-23(28)26-16-13-24(14-17-26,21-11-7-4-8-12-21)22-25-15-18-27(22)19-20-9-5-3-6-10-20/h4,7-8,11-12,15,18,20H,2-3,5-6,9-10,13-14,16-17,19H2,1H3
PDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
147n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from cloned human delta opioid receptor


Bioorg Med Chem Lett 17: 3860-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.012
BindingDB Entry DOI: 10.7270/Q2TT4QMM
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50213402
PNG
(CHEMBL234807 | ethyl 4-(1-(cyclohexylmethyl)-1H-im...)
Show SMILES CCOC(=O)N1CCC(CC1)(c1nccn1CC1CCCCC1)c1ccccc1
Show InChI InChI=1S/C24H33N3O2/c1-2-29-23(28)26-16-13-24(14-17-26,21-11-7-4-8-12-21)22-25-15-18-27(22)19-20-9-5-3-6-10-20/h4,7-8,11-12,15,18,20H,2-3,5-6,9-10,13-14,16-17,19H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>465n/an/an/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research & Development

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from cloned human mu opioid receptor


Bioorg Med Chem Lett 17: 3860-3 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.012
BindingDB Entry DOI: 10.7270/Q2TT4QMM
More data for this
Ligand-Target Pair