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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 486.5
BDBM50384206

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))
BDBM50384206
PNG
(CHEMBL2029961)
Show SMILES OC(C1CCN(CC1)C(=S)Nc1ccc(OC(F)(F)F)cc1)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C26H25F3N2O2S/c27-26(28,29)33-23-13-11-22(12-14-23)30-24(34)31-17-15-21(16-18-31)25(32,19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-14,21,32H,15-18H2,(H,30,34)
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Similars

Article
PubMed
n/an/a 1.05E+3n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at neuropeptide Y receptor Y2


Bioorg Med Chem Lett 22: 3916-20 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.107
BindingDB Entry DOI: 10.7270/Q2WH2R15
More data for this
Ligand-Target Pair