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BDBM50008982 CHEMBL168723::N-[4-Methoxymethyl-1-(2-pyrazol-1-yl-ethyl)-piperidin-4-yl]-N-phenyl-propionamide

SMILES: CCC(=O)N(c1ccccc1)C1(COC)CCN(CCn2cccn2)CC1

InChI Key: InChIKey=DOERHXQKDUFFRK-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50008982   
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
Opioid receptors; mu/kappa/delta


(Homo sapiens (Human))
BDBM50008982
PNG
(CHEMBL168723 | N-[4-Methoxymethyl-1-(2-pyrazol-1-y...)
Show SMILES CCC(=O)N(c1ccccc1)C1(COC)CCN(CCn2cccn2)CC1
Show InChI InChI=1S/C21H30N4O2/c1-3-20(26)25(19-8-5-4-6-9-19)21(18-27-2)10-14-23(15-11-21)16-17-24-13-7-12-22-24/h4-9,12-13H,3,10-11,14-18H2,1-2H3
PDB

Reactome pathway
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UniProtKB/SwissProt

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DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



Anaquest, Inc.

Curated by ChEMBL


Assay Description
In vitro binding activity against opioid receptor delta using [3H]-DPDPE) as radioligand


J Med Chem 34: 827-41 (1991)


Article DOI: 10.1021/jm00106a051
BindingDB Entry DOI: 10.7270/Q2TQ60H9
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50008982
PNG
(CHEMBL168723 | N-[4-Methoxymethyl-1-(2-pyrazol-1-y...)
Show SMILES CCC(=O)N(c1ccccc1)C1(COC)CCN(CCn2cccn2)CC1
Show InChI InChI=1S/C21H30N4O2/c1-3-20(26)25(19-8-5-4-6-9-19)21(18-27-2)10-14-23(15-11-21)16-17-24-13-7-12-22-24/h4-9,12-13H,3,10-11,14-18H2,1-2H3
UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 10n/an/an/an/an/an/a



Anaquest, Inc.

Curated by ChEMBL


Assay Description
In vitro binding activity against opioid receptor mu using [3H]-DAGO) as radioligand


J Med Chem 34: 827-41 (1991)


Article DOI: 10.1021/jm00106a051
BindingDB Entry DOI: 10.7270/Q2TQ60H9
More data for this
Ligand-Target Pair