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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 = 'BDBM50019046'   
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))		BDBM50019046
PNG
(2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propio...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(O)=O
Show InChI InChI=1S/C40H52N6O10/c1-24(2)18-31(39(53)46-35(25(3)47)40(54)55)44-38(52)32(20-26-10-6-4-7-11-26)43-34(49)21-42-37(51)33(23-56-22-28-12-8-5-9-13-28)45-36(50)30(41)19-27-14-16-29(48)17-15-27/h4-17,24-25,30-33,35,47-48H,18-23,41H2,1-3H3,(H,42,51)(H,43,49)(H,44,52)(H,45,50)(H,46,53)(H,54,55)/t25-,30+,31+,32+,33-,35+/m1/s1
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Similars
PubMed
 42n/an/an/an/an/an/an/an/a



UA 498 CNRS

Curated by ChEMBL


Assay Description
Inhibition of [3H]-DAGO binding to rat brain membrane Opioid receptor mu 1

J Med Chem 31: 1891-7 (1988)


BindingDB Entry DOI: 10.7270/Q2GB231V
More data for this
Ligand-Target Pair