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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50088720'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50088720
PNG
(CHEMBL13616 | N-Ethyl-N-(2-methyl-allyl)-4-[((1R,3...)
Show SMILES CCN(CC(C)=C)C(=O)c1ccc(cc1)N([C@H]1C[C@@H]2CC[C@H](C1)N2C)c1ccccc1 |THB:24:23:16.22.17:20.19|
Show InChI InChI=1S/C27H35N3O/c1-5-29(19-20(2)3)27(31)21-11-13-23(14-12-21)30(22-9-7-6-8-10-22)26-17-24-15-16-25(18-26)28(24)4/h6-14,24-26H,2,5,15-19H2,1,3-4H3/t24-,25+,26-
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PubMed
 2.53E+3n/an/an/an/an/an/an/an/a



R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Binding affinity of the compound was determined by inhibition of [3H]-DAMGO binding to Opioid receptor mu 1 from rat brain membranes

Bioorg Med Chem Lett 10: 1109-11 (2000)


BindingDB Entry DOI: 10.7270/Q2X0668B
More data for this
Ligand-Target Pair