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BDBM266471 US9718790, I-2266

SMILES: COC(=O)c1cccc(Oc2ccc(cc2)\N=c2/[nH]c(=O)n(C)c(=O)n2Cc2ccc(C)cc2)n1

InChI Key: InChIKey=RZJHSOYXIUIKIN-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 266471   
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))
BDBM266471
PNG
(US9718790, I-2266)
Show SMILES COC(=O)c1cccc(Oc2ccc(cc2)\N=c2/[nH]c(=O)n(C)c(=O)n2Cc2ccc(C)cc2)n1
Show InChI InChI=1S/C25H23N5O5/c1-16-7-9-17(10-8-16)15-30-23(28-24(32)29(2)25(30)33)26-18-11-13-19(14-12-18)35-21-6-4-5-20(27-21)22(31)34-3/h4-14H,15H2,1-3H3,(H,26,28,32)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 44n/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