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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 = 'BDBM50120877'   
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


(MOUSE)
BDBM50120877
PNG
(2-[(2-{5-Guanidino-2-[3-(3-hydroxy-phenyl)-2-methy...)
Show SMILES CN[C@@H](Cc1cccc(O)c1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)[C@@H](C)C(O)=O
Show InChI InChI=1S/C29H41N7O6/c1-18(28(41)42)36(3)27(40)24(16-19-9-5-4-6-10-19)35-25(38)22(13-8-14-33-29(30)31)34-26(39)23(32-2)17-20-11-7-12-21(37)15-20/h4-7,9-12,15,18,22-24,32,37H,8,13-14,16-17H2,1-3H3,(H,34,39)(H,35,38)(H,41,42)(H4,30,31,33)/t18-,22-,23-,24-/m0/s1
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Similars

PubMed
n/an/a 45n/an/an/an/an/an/a



Daiichi Fine Chemical Co. Ltd.

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards Opioid receptor mu 1 by the displacement of [3H]-DAMGO in mouse spinal cord


J Med Chem 45: 5081-9 (2002)


BindingDB Entry DOI: 10.7270/Q290233R
More data for this
Ligand-Target Pair