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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 = 'BDBM50037578'   
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))
BDBM50037578
PNG
(6-(2-{(S)-2-[(Isopropyl-methyl-amino)-methyl]-pipe...)
Show SMILES CC(C)N(C)C[C@@H]1CCCCN1C(=O)Cc1ccc2C(=O)CCCc2c1
Show InChI InChI=1S/C22H32N2O2/c1-16(2)23(3)15-19-8-4-5-12-24(19)22(26)14-17-10-11-20-18(13-17)7-6-9-21(20)25/h10-11,13,16,19H,4-9,12,14-15H2,1-3H3/t19-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
4.07n/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