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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 446.5
BDBM50445662

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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 2


(Homo sapiens (Human))
BDBM50445662
PNG
(CHEMBL3104121)
Show SMILES CCN(CC)C(=O)C(N1CCN(CC1)c1ccc(cc1F)-c1cccnc1)c1ccccc1
Show InChI InChI=1S/C27H31FN4O/c1-3-30(4-2)27(33)26(21-9-6-5-7-10-21)32-17-15-31(16-18-32)25-13-12-22(19-24(25)28)23-11-8-14-29-20-23/h5-14,19-20,26H,3-4,15-18H2,1-2H3
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Similars

Article
PubMed
n/an/a 740n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]-PYY from human NPYY2 receptor


Bioorg Med Chem Lett 24: 430-41 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.061
BindingDB Entry DOI: 10.7270/Q2H133HQ
More data for this
Ligand-Target Pair