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BDBM50244682 CHEMBL462197::N-(4-(methylsulfonyl)phenyl)-5-nitro-6-(4-(3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl)piperidin-1-yl)pyrimidin-4-amine

SMILES: CS(=O)(=O)c1ccc(Nc2ncnc(N3CCC(CC3)c3nc([n-][o+]3)-c3cccnc3)c2[N+]([O-])=O)cc1

InChI Key: InChIKey=OBUZOPJDMBTCDN-UHFFFAOYSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50244682   
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))
BDBM50244682
PNG
(CHEMBL462197 | N-(4-(methylsulfonyl)phenyl)-5-nitr...)
Show SMILES CS(=O)(=O)c1ccc(Nc2ncnc(N3CCC(CC3)c3nc([n-][o+]3)-c3cccnc3)c2[N+]([O-])=O)cc1
Show InChI InChI=1S/C23H22N8O5S/c1-37(34,35)18-6-4-17(5-7-18)27-21-19(31(32)33)22(26-14-25-21)30-11-8-15(9-12-30)23-28-20(29-36-23)16-3-2-10-24-13-16/h2-7,10,13-15H,8-9,11-12H2,1H3,(H,25,26,27)
UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 660n/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