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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 545.1
BDBM50142779

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 1


(Homo sapiens (Human))
BDBM50142779
PNG
(CHEMBL48950 | [3-({4-Butoxy-6-[2-(5-ethyl-4-methyl...)
Show SMILES CCCCOc1cc(CCc2nc(C)c(CC)s2)nc(NCc2cc(Cl)cc(NC(=O)OC(C)C)c2)c1
Show InChI InChI=1S/C28H37ClN4O3S/c1-6-8-11-35-24-15-22(9-10-27-31-19(5)25(7-2)37-27)32-26(16-24)30-17-20-12-21(29)14-23(13-20)33-28(34)36-18(3)4/h12-16,18H,6-11,17H2,1-5H3,(H,30,32)(H,33,34)
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Similars

Article
PubMed
n/an/a 16n/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against human recombinant NPY Y1 receptor in CHO/dhFr- cell membranes using [125I]-PYY


Bioorg Med Chem Lett 14: 1761-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.01.049
BindingDB Entry DOI: 10.7270/Q26D5SFV
More data for this
Ligand-Target Pair