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BDBM50244639 CHEMBL451798::{6-[4-(3-Cyclopropyl-[1,2,4]oxadiazol-5-yl)-piperidin-1-yl]-5-nitro-pyrimidin-4-yl}-(4-methanesulfonylphenyl)-amine

SMILES: CS(=O)(=O)c1ccc(Nc2ncnc(N3CCC(CC3)c3nc([n-][o+]3)C3CC3)c2[N+]([O-])=O)cc1

InChI Key: InChIKey=RMQBCFUMFGANFC-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50244639   
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
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))		BDBM50244639
PNG
(CHEMBL451798 | {6-[4-(3-Cyclopropyl-[1,2,4]oxadiaz...)
Show SMILES CS(=O)(=O)c1ccc(Nc2ncnc(N3CCC(CC3)c3nc([n-][o+]3)C3CC3)c2[N+]([O-])=O)cc1
Show InChI InChI=1S/C21H23N7O5S/c1-34(31,32)16-6-4-15(5-7-16)24-19-17(28(29)30)20(23-12-22-19)27-10-8-14(9-11-27)21-25-18(26-33-21)13-2-3-13/h4-7,12-14H,2-3,8-11H2,1H3,(H,22,23,24)
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Article
PubMed
n/an/an/an/a 25n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at CPR119 (unknown origin) transfected in Xenopus dermal melanophore assessed as dispersion of melatonin-induced pigmentation

J Med Chem 51: 5172-5 (2008)


Article DOI: 10.1021/jm8006867
BindingDB Entry DOI: 10.7270/Q2KW5FVB
More data for this
Ligand-Target Pair