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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 461.5
BDBM50352387

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))
BDBM50352387
PNG
(CHEMBL1823358)
Show SMILES CCNC(=O)C(N1CCN(CC1)c1ccc(NC(=O)C(CC)CC)cc1C#N)c1ccccc1
Show InChI InChI=1S/C27H35N5O2/c1-4-20(5-2)26(33)30-23-12-13-24(22(18-23)19-28)31-14-16-32(17-15-31)25(27(34)29-6-3)21-10-8-7-9-11-21/h7-13,18,20,25H,4-6,14-17H2,1-3H3,(H,29,34)(H,30,33)
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Similars

Article
PubMed
n/an/a 150n/an/an/an/an/an/a



Johnson& Johnson Pharmaceutical Research& Development

Curated by ChEMBL


Assay Description
Displacement of [125I]PYY from human NPY Y2 receptor expressed endogenously in KAN-Ts cells by scintillation counting


Bioorg Med Chem Lett 21: 5552-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.136
BindingDB Entry DOI: 10.7270/Q2R49R5K
More data for this
Ligand-Target Pair