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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Toll-like receptor 7' and Ligand = 'BDBM307533'   
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
Toll-like receptor 7


(Homo sapiens (Human))
BDBM307533
PNG
((S)-1-(4-((2-amino-4-(1-hydroxyhexan-3-ylamino)-6-...)
Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc(C)c1Cc1ccc(Cn2cncc2C(O)=O)cc1OC |r|
Show InChI InChI=1S/C24H32N6O4/c1-4-5-18(8-9-31)28-22-19(15(2)27-24(25)29-22)11-17-7-6-16(10-21(17)34-3)13-30-14-26-12-20(30)23(32)33/h6-7,10,12,14,18,31H,4-5,8-9,11,13H2,1-3H3,(H,32,33)(H3,25,27,28,29)/t18-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 2.00E+3n/an/an/an/a



Sumitomo Dainippon Pharma Co., Ltd.

US Patent


Assay Description
Recombinant human TLR7 was stably expressed in a HEK293 cell line already stably expressing the pNiFty2-SEAP reporter plasmid; integration of the rep...


US Patent US10562861 (2020)


BindingDB Entry DOI: 10.7270/Q22F7QTT
More data for this
Ligand-Target Pair
Toll-like receptor 7


(Homo sapiens (Human))
BDBM307533
PNG
((S)-1-(4-((2-amino-4-(1-hydroxyhexan-3-ylamino)-6-...)
Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc(C)c1Cc1ccc(Cn2cncc2C(O)=O)cc1OC |r|
Show InChI InChI=1S/C24H32N6O4/c1-4-5-18(8-9-31)28-22-19(15(2)27-24(25)29-22)11-17-7-6-16(10-21(17)34-3)13-30-14-26-12-20(30)23(32)33/h6-7,10,12,14,18,31H,4-5,8-9,11,13H2,1-3H3,(H,32,33)(H3,25,27,28,29)/t18-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 5.70E+3n/an/an/an/a



Sumitomo Dainippon Pharma Co., Ltd.

US Patent


Assay Description
Recombinant human TLR7 was stably expressed in a HEK293 cell line already stably expressing the pNiFty2-SEAP reporter plasmid; integration of the rep...


US Patent US10150743 (2018)


BindingDB Entry DOI: 10.7270/Q2MW2K6N
More data for this
Ligand-Target Pair