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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 = 'BDBM50491880'   
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))		BDBM50491880
PNG
(CHEMBL2387724)
Show SMILES Cl.[H][C@@]12Oc3c4c(C[C@@]5([H])N(CC6CC6)CC[C@]14[C@@]51CC[C@@]2(O)[C@@H](CC(=O)NCc2ccccc2)N1C)ccc3O |r,THB:35:18:5.7.6:16.10.15,4:5:18:16.10.15,24:23:2.17:19.20,36:35:2.17:19.20|
Show InChI InChI=1S/C31H37N3O4.ClH/c1-33-23(16-25(36)32-17-19-5-3-2-4-6-19)30(37)11-12-31(33)24-15-21-9-10-22(35)27-26(21)29(31,28(30)38-27)13-14-34(24)18-20-7-8-20;/h2-6,9-10,20,23-24,28,35,37H,7-8,11-18H2,1H3,(H,32,36);1H/t23-,24-,28-,29-,30-,31-;/m1./s1
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
 0.150n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig cerebellum

Bioorg Med Chem 21: 3032-50 (2013)


Article DOI: 10.1016/j.bmc.2013.03.026
BindingDB Entry DOI: 10.7270/Q2JQ13XJ
More data for this
Ligand-Target Pair