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BDBM50353157 CHEMBL1829329

SMILES: COc1ccc2N(CCN[C@H]3CC[C@H](CNS(=O)(=O)C(C)C)CC3)CCOc2c1

InChI Key: InChIKey=ZNJMSPBOTLSQBR-IYARVYRRSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50353157   
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))		BDBM50353157
PNG
(CHEMBL1829329)
Show SMILES COc1ccc2N(CCN[C@H]3CC[C@H](CNS(=O)(=O)C(C)C)CC3)CCOc2c1 |r,wU:13.13,wD:10.9,(-9.34,-36.38,;-9.34,-37.92,;-8.01,-38.7,;-6.68,-37.92,;-5.34,-38.69,;-5.34,-40.24,;-4,-41,;-2.67,-40.23,;-1.34,-40.99,;-.01,-40.22,;1.32,-40.99,;1.32,-42.53,;2.65,-43.3,;3.99,-42.53,;5.32,-43.31,;6.65,-42.53,;7.98,-43.31,;7.2,-44.64,;8.74,-44.64,;9.31,-42.54,;10.64,-43.32,;9.32,-41,;3.99,-40.99,;2.65,-40.22,;-4.01,-42.54,;-5.34,-43.31,;-6.67,-42.53,;-6.67,-41,;-8.01,-40.24,)|
Show InChI InChI=1S/C21H35N3O4S/c1-16(2)29(25,26)23-15-17-4-6-18(7-5-17)22-10-11-24-12-13-28-21-14-19(27-3)8-9-20(21)24/h8-9,14,16-18,22-23H,4-7,10-13,15H2,1-3H3/t17-,18-
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Article
PubMed
 88n/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