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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Opioid receptors; mu/kappa/delta' and Ligand = 'BDBM50229956'   
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
Opioid receptors; mu/kappa/delta


(Homo sapiens (Human))
BDBM50229956
PNG
(CHEMBL153616)
Show SMILES Oc1cccc(c1)C12CCN(CC3CC3)C[C@@H]1CCC(=O)C2
Show InChI InChI=1S/C19H25NO2/c21-17-3-1-2-15(10-17)19-8-9-20(12-14-4-5-14)13-16(19)6-7-18(22)11-19/h1-3,10,14,16,21H,4-9,11-13H2/t16-,19?/m0/s1
PDB

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 120n/an/an/an/an/an/a



Glaxo Group Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against opioid receptor in Guinea pig ileum


J Med Chem 35: 48-56 (1992)


Article DOI: 10.1021/jm00079a005
BindingDB Entry DOI: 10.7270/Q2J105DC
More data for this
Ligand-Target Pair