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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 = 'BDBM50327278'   
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


(Homo sapiens (Human))
BDBM50327278
PNG
(CHEMBL1257459 | endo-3-(8-((R)-1-(2-chloropyridin-...)
Show SMILES C[C@@H](N1[C@H]2CC[C@@H]1C[C@H](C2)Oc1cccc(c1)C(N)=O)c1ccnc(Cl)c1 |r,TLB:1:2:8.7.9:5.4|
Show InChI InChI=1S/C21H24ClN3O2/c1-13(14-7-8-24-20(22)10-14)25-16-5-6-17(25)12-19(11-16)27-18-4-2-3-15(9-18)21(23)26/h2-4,7-10,13,16-17,19H,5-6,11-12H2,1H3,(H2,23,26)/t13-,16-,17+,19-/m1/s1
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Similars

Article
PubMed
n/an/a 2.29E+4n/an/an/an/an/an/a



AstraZeneca Pharmaceuticals

Curated by ChEMBL


Assay Description
Antagonist activity at human mu opioid receptor assessed as inhibition of DAMGO-stimulated [35S]GTPgammaS binding


Bioorg Med Chem Lett 20: 5847-52 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.113
BindingDB Entry DOI: 10.7270/Q23F4PV1
More data for this
Ligand-Target Pair