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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'p2x3' and Ligand = 'BDBM271540'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
p2x3


(Homo sapiens (human))
BDBM271540
PNG
(US10065941, Compound I-041)
Show SMILES Cc1ccc(Cn2c(=O)n(CC(C)(C)C(O)=O)c(=O)[nH]\c2=N/c2ccc(Oc3ccc(F)cn3)cc2)cc1
Show InChI InChI=1S/C27H26FN5O5/c1-17-4-6-18(7-5-17)15-32-24(31-25(36)33(26(32)37)16-27(2,3)23(34)35)30-20-9-11-21(12-10-20)38-22-13-8-19(28)14-29-22/h4-14H,15-16H2,1-3H3,(H,34,35)(H,30,31,36)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 9n/an/an/an/a7.5n/a



SHIONOGI & CO., LTD.

US Patent


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


US Patent US10065941 (2018)

More data for this
Ligand-Target Pair