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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 = 'BDBM50091007'   
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


(Cavia porcellus (domestic guinea pig))
BDBM50091007
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCN |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C37H54N4O3/c1-25(2)20-32(34(43)39-18-11-6-5-10-17-38)40-35(44)37(28-12-8-7-9-13-28)23-29(37)24-41-19-16-36(4)26(3)33(41)21-27-14-15-30(42)22-31(27)36/h7-9,12-15,22,25-26,29,32-33,42H,5-6,10-11,16-21,23-24,38H2,1-4H3,(H,39,43)(H,40,44)/t26?,29?,32?,33?,36-,37+/m1/s1
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
242n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair