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BDBM50092713 CHEMBL338089::N,N-Diethyl-4-[phenyl-(1-phenyl-piperidin-4-ylidene)-methyl]-benzamide

SMILES: [#6]-[#6]-[#7](-[#6]-[#6])-[#6](=O)-c1ccc(cc1)-[#6](=[#6]-1/[#6]-[#6]-[#7](-[#6]-[#6]-1)-c1ccccc1)\c1ccccc1

InChI Key: InChIKey=TZZSVBXJFGPKDB-UHFFFAOYSA-N

Data: 3 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50092713   
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))
BDBM50092713
PNG
(CHEMBL338089 | N,N-Diethyl-4-[phenyl-(1-phenyl-pip...)
Show SMILES [#6]-[#6]-[#7](-[#6]-[#6])-[#6](=O)-c1ccc(cc1)-[#6](=[#6]-1/[#6]-[#6]-[#7](-[#6]-[#6]-1)-c1ccccc1)\c1ccccc1
Show InChI InChI=1S/C29H32N2O/c1-3-30(4-2)29(32)26-17-15-24(16-18-26)28(23-11-7-5-8-12-23)25-19-21-31(22-20-25)27-13-9-6-10-14-27/h5-18H,3-4,19-22H2,1-2H3
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PC cid
PC sid
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n/an/a 736n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity on cloned opioid receptor delta 1 in human HEK293S cells using [125I]-[D-Ala2]-deltorphin II as radioligand.


J Med Chem 43: 3895-905 (2000)


BindingDB Entry DOI: 10.7270/Q2KW5F95
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092713
PNG
(CHEMBL338089 | N,N-Diethyl-4-[phenyl-(1-phenyl-pip...)
Show SMILES [#6]-[#6]-[#7](-[#6]-[#6])-[#6](=O)-c1ccc(cc1)-[#6](=[#6]-1/[#6]-[#6]-[#7](-[#6]-[#6]-1)-c1ccccc1)\c1ccccc1
Show InChI InChI=1S/C29H32N2O/c1-3-30(4-2)29(32)26-17-15-24(16-18-26)28(23-11-7-5-8-12-23)25-19-21-31(22-20-25)27-13-9-6-10-14-27/h5-18H,3-4,19-22H2,1-2H3
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PC sid
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity on cloned opioid receptor mu 1 in human HEK293S cells using [125I]FK33824 as radioligand.


J Med Chem 43: 3895-905 (2000)


BindingDB Entry DOI: 10.7270/Q2KW5F95
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092713
PNG
(CHEMBL338089 | N,N-Diethyl-4-[phenyl-(1-phenyl-pip...)
Show SMILES [#6]-[#6]-[#7](-[#6]-[#6])-[#6](=O)-c1ccc(cc1)-[#6](=[#6]-1/[#6]-[#6]-[#7](-[#6]-[#6]-1)-c1ccccc1)\c1ccccc1
Show InChI InChI=1S/C29H32N2O/c1-3-30(4-2)29(32)26-17-15-24(16-18-26)28(23-11-7-5-8-12-23)25-19-21-31(22-20-25)27-13-9-6-10-14-27/h5-18H,3-4,19-22H2,1-2H3
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PC sid
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n/an/a 3.16E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity on cloned opioid receptor kappa 1 in human HEK293S cells using [125I]-D-Pro10-dynorphin A[1-11] as radioligand.


J Med Chem 43: 3895-905 (2000)


BindingDB Entry DOI: 10.7270/Q2KW5F95
More data for this
Ligand-Target Pair