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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 = 'BDBM50036797'   
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))		BDBM50036797
PNG
(2-Amino-3-[4-(4-cyano-benzyloxy)-2,6-dimethyl-phen...)
Show SMILES C[C@@H](NC(=O)C(N)Cc1c(C)cc(OCc2ccc(cc2)C#N)cc1C)C(=O)NCCCc1ccccc1
Show InChI InChI=1S/C31H36N4O3/c1-21-16-27(38-20-26-13-11-25(19-32)12-14-26)17-22(2)28(21)18-29(33)31(37)35-23(3)30(36)34-15-7-10-24-8-5-4-6-9-24/h4-6,8-9,11-14,16-17,23,29H,7,10,15,18,20,33H2,1-3H3,(H,34,36)(H,35,37)/t23-,29?/m1/s1
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Similars
PubMed
n/an/a 28.6n/an/an/an/an/an/a



Searle

Curated by ChEMBL


Assay Description
Affinity for mu opioid receptor was measured by displacement of tritiated DAMGO from rat brain membranes

J Med Chem 37: 888-96 (1994)


BindingDB Entry DOI: 10.7270/Q27H1HN2
More data for this
Ligand-Target Pair