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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neuropeptide Y receptor type 5' and Ligand = 'BDBM50353137'   
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
Neuropeptide Y receptor type 5


(Homo sapiens (Human))		BDBM50353137
PNG
(CHEMBL1829309)
Show SMILES CN(C)S(=O)(=O)NC[C@H]1CC[C@@H](CC1)NC(=O)CN1c2ccccc2SC(C)(C)CC1=O |r,wU:11.14,wD:8.7,(10.2,.26,;8.85,1,;8.82,2.54,;7.54,.2,;6.76,-1.12,;8.3,-1.12,;6.19,.94,;4.87,.15,;3.52,.89,;3.49,2.43,;2.13,3.17,;.83,2.36,;.86,.82,;2.2,.09,;-.52,3.1,;-1.84,2.3,;-1.8,.76,;-3.19,3.03,;-4.5,2.23,;-5.69,3.24,;-5.19,4.69,;-6.19,5.86,;-7.71,5.58,;-8.22,4.12,;-7.22,2.94,;-7.94,1.56,;-7.3,.13,;-7.32,-1.4,;-8.65,-.62,;-5.79,-.26,;-4.54,.67,;-3.18,-.04,)|
Show InChI InChI=1S/C22H34N4O4S2/c1-22(2)13-21(28)26(18-7-5-6-8-19(18)31-22)15-20(27)24-17-11-9-16(10-12-17)14-23-32(29,30)25(3)4/h5-8,16-17,23H,9-15H2,1-4H3,(H,24,27)/t16-,17-
KEGG

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PC cid
PC sid
UniChem

Similars
Article
PubMed
 27n/an/an/an/an/an/an/an/a



Lundbeck Research USA, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]PYY from human NPY5 receptor expressed in thymidine kinase deficient mouse LM cells after 120 mins by scintillation counting

Bioorg Med Chem Lett 21: 5573-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.078
BindingDB Entry DOI: 10.7270/Q2TQ61X3
More data for this
Ligand-Target Pair