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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 548.6
BDBM50445678

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))
BDBM50445678
PNG
(CHEMBL3104203)
Show SMILES CCN(CC)C(=O)C(N1CCN(CC1)c1ccc(NC(=O)c2c(C)cnn2C(C)(C)C)cc1F)c1ccccc1
Show InChI InChI=1S/C31H41FN6O2/c1-7-35(8-2)30(40)28(23-12-10-9-11-13-23)37-18-16-36(17-19-37)26-15-14-24(20-25(26)32)34-29(39)27-22(3)21-33-38(27)31(4,5)6/h9-15,20-21,28H,7-8,16-19H2,1-6H3,(H,34,39)
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Similars

Article
PubMed
n/an/a 300n/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