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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 = 'BDBM50453764'   
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))		BDBM50453764
PNG
(CHEMBL4211768)
Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(N)=O |r|
Show InChI InChI=1S/C34H38ClN7O6/c1-19(40-33(47)26(36)14-20-8-12-24(43)13-9-20)32(46)39-18-30(44)41-29(16-22-17-38-27-5-3-2-4-25(22)27)34(48)42-28(31(37)45)15-21-6-10-23(35)11-7-21/h2-13,17,19,26,28-29,38,43H,14-16,18,36H2,1H3,(H2,37,45)(H,39,46)(H,40,47)(H,41,44)(H,42,48)/t19-,26+,28+,29+/m1/s1
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PC cid
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Article
PubMed
 7.70n/an/an/an/an/an/an/an/a



The First Hospital of Lanzhou University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO from mu opioid receptor in Wistar rat brain membranes preincubated for 1 hr measured after 1hr by scintillation counting m...

Bioorg Med Chem Lett 27: 1557-1560 (2017)


Article DOI: 10.1016/j.bmcl.2017.02.034
BindingDB Entry DOI: 10.7270/Q2DN47NT
More data for this
Ligand-Target Pair