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SMILES: COc1nc(C)c2nc(-c3cncc(C)c3)n(Cc3ccc(cc3F)C3CN4CCC3CC4)c2n1

InChI Key: InChIKey=GHLHUZVVQZZNAU-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 450122   
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
Toll-like receptor 7


(Homo sapiens (Human))		BDBM450122
PNG
(US10703755, Example 305)
Show SMILES COc1nc(C)c2nc(-c3cncc(C)c3)n(Cc3ccc(cc3F)C3CN4CCC3CC4)c2n1 |(-8.57,1.02,;-7.39,.03,;-6.06,.8,;-6.06,2.34,;-4.73,3.11,;-4.73,4.65,;-3.39,2.34,;-1.93,2.81,;-1.02,1.57,;.52,1.57,;1.29,.23,;2.83,.23,;3.6,1.57,;2.84,3,;3.59,4.34,;1.29,2.9,;-1.93,.32,;-1.53,-1.17,;-.04,-1.57,;1.05,-.48,;2.53,-.87,;2.93,-2.36,;1.84,-3.45,;.36,-3.05,;-.73,-4.14,;4.42,-2.76,;4.82,-4.25,;6.31,-4.65,;7.39,-3.56,;7,-2.07,;5.51,-1.67,;5.51,-3.21,;6.31,-3.11,;-3.39,.8,;-4.73,.03,)|
Show InChI InChI=1S/C27H29FN6O/c1-16-10-21(13-29-12-16)25-31-24-17(2)30-27(35-3)32-26(24)34(25)14-20-5-4-19(11-23(20)28)22-15-33-8-6-18(22)7-9-33/h4-5,10-13,18,22H,6-9,14-15H2,1-3H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5n/an/an/an/an/an/a



SUMITOMO DAINIPPON PHARMA CO., LTD.

US Patent


Assay Description
As human TLR7 expressing cell line, HEK293 cell line was bought from IMGENEX Corporation (TLR7/NF-ηB/SEAPorter™ HEK293 cell), which is human emb...

US Patent US10703755 (2020)

More data for this
Ligand-Target Pair