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BDBM265325 US9718790, I-1820

SMILES: C[C@H]([C@H](C)n1c(=O)[nH]\c(=N/c2ccc3OCCCc3c2)n(Cc2ccc(Cl)cc2)c1=O)C(O)=O

InChI Key: InChIKey=IMWASKXIVUEMIR-PVRQQBJHNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 265325   
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
P2X purinoceptor 3


(Homo sapiens (Human))
BDBM265325
PNG
(US9718790, I-1820)
Show SMILES C[C@H]([C@H](C)n1c(=O)[nH]\c(=N/c2ccc3OCCCc3c2)n(Cc2ccc(Cl)cc2)c1=O)C(O)=O
Show InChI InChI=1/C24H25ClN4O5/c1-14(21(30)31)15(2)29-23(32)27-22(26-19-9-10-20-17(12-19)4-3-11-34-20)28(24(29)33)13-16-5-7-18(25)8-6-16/h5-10,12,14-15H,3-4,11,13H2,1-2H3,(H,30,31)(H,26,27,32)/t14-,15+/s2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 204n/an/an/an/a7.5n/a



Shionogi & Co., Ltd

US Patent


Assay Description
Stably expressing cell line (C6BU-1 transfected with human P2X3 receptor gene (GenBank accession number Y07683) was used. The cells were seeded in a ...


US Patent US9718790 (2017)


Article DOI: 10.1021/jm970615f
BindingDB Entry DOI: 10.7270/Q22809KB
More data for this
Ligand-Target Pair