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BDBM50155112 1N-ethyl-4-{4-carbamoylphenyl[8-(3-furylmethyl)-8-azabicyclo[3.2.1]oct-3-yliden]methyl}benzamide::CHEMBL365068

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

InChI Key: InChIKey=WUPVIRQMADHFDN-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50155112   
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)		BDBM50155112
PNG
(1N-ethyl-4-{4-carbamoylphenyl[8-(3-furylmethyl)-8-...)
Show SMILES [#6]-[#6]-[#7]-[#6](=O)-c1ccc(cc1)-[#6](=[#6]-1/[#6]-[#6]-2-[#6]-[#6]-[#6](-[#6]-1)-[#7]-2-[#6]-c1ccoc1)\c1ccc(cc1)-[#6](-[#7])=O
Show InChI InChI=1S/C29H31N3O3/c1-2-31-29(34)23-9-5-21(6-10-23)27(20-3-7-22(8-4-20)28(30)33)24-15-25-11-12-26(16-24)32(25)17-19-13-14-35-18-19/h3-10,13-14,18,25-26H,2,11-12,15-17H2,1H3,(H2,30,33)(H,31,34)
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Similars
Article
PubMed
 1.30n/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