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BDBM198949 US9221832, 13

SMILES: O=C(Cc1ccc(cc1)C#N)NC1COc2ncccc12

InChI Key: InChIKey=HERBSLBUDATHNP-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 198949   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM198949
PNG
(US9221832, 13)
Show SMILES O=C(Cc1ccc(cc1)C#N)NC1COc2ncccc12
Show InChI InChI=1S/C16H13N3O2/c17-9-12-5-3-11(4-6-12)8-15(20)19-14-10-21-16-13(14)2-1-7-18-16/h1-7,14H,8,10H2,(H,19,20)
PDB

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antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a>5.42E+3n/an/an/an/an/an/a



Actelion Pharmaceuticals Ltd

US Patent


Assay Description
Cell line generation was performed in general according to established molecular cloning protocols. Specifically, RNA was extracted from human whol...


US Patent US9221832 (2015)


BindingDB Entry DOI: 10.7270/Q2C53JPG
More data for this
Ligand-Target Pair