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BDBM266339 US9718790, I-1471

SMILES: CCc1nc2ccc(cc2s1)\N=c1/[nH]c(=O)n([C@@H](C)[C@@H](C)C(O)=O)c(=O)n1Cc1ccc(C)cc1

InChI Key: InChIKey=KYLVIEOPCCQCSE-REIYMHPCNA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 266339   
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))
BDBM266339
PNG
(US9718790, I-1471)
Show SMILES CCc1nc2ccc(cc2s1)\N=c1/[nH]c(=O)n([C@@H](C)[C@@H](C)C(O)=O)c(=O)n1Cc1ccc(C)cc1
Show InChI InChI=1/C25H27N5O4S/c1-5-21-27-19-11-10-18(12-20(19)35-21)26-23-28-24(33)30(16(4)15(3)22(31)32)25(34)29(23)13-17-8-6-14(2)7-9-17/h6-12,15-16H,5,13H2,1-4H3,(H,31,32)(H,26,28,33)/t15-,16+/s2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 7n/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