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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Toll-like receptor 7' and Ligand = 'BDBM507042'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Toll-like receptor 7


(Homo sapiens (Human))
BDBM507042
PNG
(2-Amino-N-(cyclopropylmethyl)-8-(1,4-dihydroquinaz...)
Show SMILES CCCN(CC1CC1)C(=O)C1=Cc2ccc(cc2N=C(N)C1)C1=NCc2ccccc2N1
Show InChI InChI=1S/C26H29N5O/c1-2-11-31(16-17-7-8-17)26(32)21-12-18-9-10-19(13-23(18)29-24(27)14-21)25-28-15-20-5-3-4-6-22(20)30-25/h3-6,9-10,12-13,17H,2,7-8,11,14-16H2,1H3,(H2,27,29)(H,28,30)
PDB

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PC cid
PC sid
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US Patent
n/an/an/an/a>1.00E+5n/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
For TLR8 and TLR7 activity testing, HEK-Blue human TLR8 or TLR7 cells (Invivogen, San Diego, Calif., USA) are used, respectively. These cells are des...


US Patent US11046671 (2021)

More data for this
Ligand-Target Pair