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BDBM50155107 CHEMBL185229::N-Ethyl-4-[(4-fluoro-phenyl)-(8-furan-3-ylmethyl-8-aza-bicyclo[3.2.1]oct-3-ylidene)-methyl]-benzamide

SMILES: [#6]-[#6]-[#7]-[#6](=O)-c1ccc(cc1)-[#6](=[#6]-1/[#6]-[#6]-2-[#6]-[#6]-[#6](-[#6]-1)-[#7]-2-[#6]-c1ccoc1)\c1ccc(F)cc1

InChI Key: InChIKey=VLGAHHOYYSVFIL-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50155107   
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


(MOUSE)
BDBM50155107
PNG
(CHEMBL185229 | N-Ethyl-4-[(4-fluoro-phenyl)-(8-fur...)
Show SMILES CCNC(=O)c1ccc(cc1)C(=C1CC2CCC(C1)N2Cc1ccoc1)c1ccc(F)cc1
Show InChI InChI=1S/C28H29FN2O2/c1-2-30-28(32)22-5-3-20(4-6-22)27(21-7-9-24(29)10-8-21)23-15-25-11-12-26(16-23)31(25)17-19-13-14-33-18-19/h3-10,13-14,18,25-26H,2,11-12,15-17H2,1H3,(H,30,32)
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Similars

Article
PubMed
1.70n/an/an/an/an/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Binding affinity against mu opioid receptor in mouse hot plate test


Bioorg Med Chem Lett 14: 5493-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.004
BindingDB Entry DOI: 10.7270/Q2X34WZV
More data for this
Ligand-Target Pair