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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neuropeptide Y receptor type 1' and Ligand = 'BDBM50342732'   
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))
BDBM50342732
PNG
(CHEMBL1771255 | N1-(3-mesityl-2,5-dimethylpyrazolo...)
Show SMILES COc1ccc(CCNCCNc2cc(C)nc3c(c(C)nn23)-c2c(C)cc(C)cc2C)cc1 |(23.86,-.34,;22.53,-1.12,;21.19,-.35,;19.86,-1.13,;18.52,-.36,;18.53,1.18,;17.19,1.94,;15.86,1.17,;14.52,1.94,;13.19,1.17,;11.86,1.93,;10.52,1.16,;10.53,-.38,;11.86,-1.14,;11.87,-2.69,;13.2,-3.46,;10.53,-3.47,;9.2,-2.7,;7.72,-3.17,;6.82,-1.92,;5.28,-1.92,;7.73,-.67,;9.2,-1.15,;6.97,-4.51,;5.43,-4.52,;4.65,-3.19,;4.68,-5.86,;5.46,-7.19,;4.7,-8.53,;7.01,-7.17,;7.76,-5.82,;9.3,-5.8,;19.85,1.95,;21.18,1.19,)|
Show InChI InChI=1S/C28H35N5O/c1-18-15-19(2)26(20(3)16-18)27-22(5)32-33-25(17-21(4)31-28(27)33)30-14-13-29-12-11-23-7-9-24(34-6)10-8-23/h7-10,15-17,29-30H,11-14H2,1-6H3
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Similars

Article
PubMed
29n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]-PYY from human recombinant NPY Y1 receptor overexpressed in membrane of Sf9 cells


Bioorg Med Chem Lett 21: 2641-5 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.116
BindingDB Entry DOI: 10.7270/Q2BP0336
More data for this
Ligand-Target Pair