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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM50037577'   
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
Kappa-type opioid receptor


(Mus musculus (Mouse))
BDBM50037577
PNG
(6-[2-Oxo-2-((S)-2-pyrrolidin-1-ylmethyl-piperidin-...)
Show SMILES O=C(Cc1ccc2C(=O)CCCc2c1)N1CCCC[C@H]1CN1CCCC1
Show InChI InChI=1S/C22H30N2O2/c25-21-8-5-6-18-14-17(9-10-20(18)21)15-22(26)24-13-2-1-7-19(24)16-23-11-3-4-12-23/h9-10,14,19H,1-8,11-13,15-16H2/t19-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
7.60n/an/an/an/an/an/an/an/a



SmithKline Beecham Farmaceutici S.p.A.

Curated by ChEMBL


Assay Description
Evaluated for the binding affinity at kappa receptor


J Med Chem 37: 3482-91 (1994)


BindingDB Entry DOI: 10.7270/Q2W37VB6
More data for this
Ligand-Target Pair