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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 = 'BDBM50041146'   
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))		BDBM50041146
PNG
((S)-2-Amino-3-(4-hydroxy-phenyl)-N-[(5S,8R,16aR)-5...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CCCNC(=O)CNC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O
Show InChI InChI=1S/C32H39N7O6/c33-23(15-19-9-11-21(40)12-10-19)29(42)37-25-7-3-13-34-28(41)18-36-31(44)27-8-4-14-39(27)32(45)26(38-30(25)43)16-20-17-35-24-6-2-1-5-22(20)24/h1-2,5-6,9-12,17,23,25-27,35,40H,3-4,7-8,13-16,18,33H2,(H,34,41)(H,36,44)(H,37,42)(H,38,43)/t23-,25+,26-,27+/m0/s1
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Similars
PubMed
 2.10n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Binding affinity for mu opioid receptors by displacement of [3H]-DAMGO from rat brain membrane binding site

J Med Chem 37: 1136-44 (1994)


BindingDB Entry DOI: 10.7270/Q22Z1650
More data for this
Ligand-Target Pair