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BDBM50353138 CHEMBL1829310

SMILES: CN(C)S(=O)(=O)NC[C@H]1CC[C@@H](CC1)NC(=O)CN1c2ccccc2SCCC1=O

InChI Key: InChIKey=TVNDPOXRRPSCJC-WKILWMFISA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50353138   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Neuropeptide Y receptor type 5 ( NPY Y5)


(Homo sapiens (Human))		BDBM50353138
PNG
(CHEMBL1829310)
Show SMILES CN(C)S(=O)(=O)NC[C@H]1CC[C@@H](CC1)NC(=O)CN1c2ccccc2SCCC1=O |r,wU:11.14,wD:8.7,(32.54,-1.69,;31.19,-.95,;31.16,.59,;29.87,-1.75,;29.09,-3.07,;30.63,-3.07,;28.52,-1.01,;27.21,-1.81,;25.86,-1.07,;25.82,.48,;24.47,1.22,;23.17,.41,;23.2,-1.13,;24.54,-1.86,;21.81,1.15,;20.5,.35,;20.54,-1.19,;19.15,1.08,;17.83,.28,;16.64,1.29,;17.15,2.74,;16.15,3.91,;14.63,3.62,;14.12,2.17,;15.12,.99,;14.4,-.39,;15.03,-1.82,;16.55,-2.21,;17.79,-1.28,;19.16,-1.99,)|
Show InChI InChI=1S/C20H30N4O4S2/c1-23(2)30(27,28)21-13-15-7-9-16(10-8-15)22-19(25)14-24-17-5-3-4-6-18(17)29-12-11-20(24)26/h3-6,15-16,21H,7-14H2,1-2H3,(H,22,25)/t15-,16-
KEGG

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Article
PubMed
 420n/an/an/an/an/an/an/an/a



Lundbeck Research USA, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]PYY from human NPY5 receptor expressed in thymidine kinase deficient mouse LM cells after 120 mins by scintillation counting

Bioorg Med Chem Lett 21: 5573-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.078
BindingDB Entry DOI: 10.7270/Q2TQ61X3
More data for this
Ligand-Target Pair