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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nociceptin/mu opioid receptor' and Ligand = 'BDBM50430616'   
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
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50430616
PNG
(CHEMBL2338738)
Show SMILES CO[C@]12CC[C@@]3(C[C@@H]1[C@H](O)CC(C)C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1CC1CC1)c45 |r,THB:8:7:24.23:4.3|
Show InChI InChI=1S/C28H39NO4/c1-16(2)12-21(31)19-14-26-8-9-28(19,32-3)25-27(26)10-11-29(15-17-4-5-17)22(26)13-18-6-7-20(30)24(33-25)23(18)27/h6-7,16-17,19,21-22,25,30-31H,4-5,8-15H2,1-3H3/t19-,21-,22-,25-,26-,27+,28-/m1/s1
PDB

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
0.0540n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]-diprenorphine from rat recombinant MOR expressed in rat C6 cells after 2 hrs


J Med Chem 56: 3207-16 (2013)


Article DOI: 10.1021/jm301543e
BindingDB Entry DOI: 10.7270/Q28G8N2Q
More data for this
Ligand-Target Pair