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Target
Toll-like receptor 7
Ligand
BDBM450162
Substrate
n/a
Meas. Tech.
Inhibition of the Activation Assay
IC50
18.0±n/a nM
Citation
 Tojo, S; Isobe, Y; Ideue, E; Fujiwara, H; Urabe, D Substituted purine derivative US Patent  US10703755 Publication Date 7/7/2020 
Target
Name:
Toll-like receptor 7
Synonyms:
ORF Names:UNQ248/PRO285 | TLR7 | TLR7_HUMAN | Toll-like receptor 7 (TLR7)
Type:
Enzyme
Mol. Mass.:
120945.35
Organism:
Homo sapiens (Human)
Description:
Q9NYK1
Residue:
1049
Sequence:
MVFPMWTLKRQILILFNIILISKLLGARWFPKTLPCDVTLDVPKNHVIVDCTDKHLTEIPGGIPTNTTNLTLTINHIPDISPASFHRLDHLVEIDFRCNCVPIPLGSKNNMCIKRLQIKPRSFSGLTYLKSLYLDGNQLLEIPQGLPPSLQLLSLEANNIFSIRKENLTELANIEILYLGQNCYYRNPCYVSYSIEKDAFLNLTKLKVLSLKDNNVTAVPTVLPSTLTELYLYNNMIAKIQEDDFNNLNQLQILDLSGNCPRCYNAPFPCAPCKNNSPLQIPVNAFDALTELKVLRLHSNSLQHVPPRWFKNINKLQELDLSQNFLAKEIGDAKFLHFLPSLIQLDLSFNFELQVYRASMNLSQAFSSLKSLKILRIRGYVFKELKSFNLSPLHNLQNLEVLDLGTNFIKIANLSMFKQFKRLKVIDLSVNKISPSGDSSEVGFCSNARTSVESYEPQVLEQLHYFRYDKYARSCRFKNKEASFMSVNESCYKYGQTLDLSKNSIFFVKSSDFQHLSFLKCLNLSGNLISQTLNGSEFQPLAELRYLDFSNNRLDLLHSTAFEELHKLEVLDISSNSHYFQSEGITHMLNFTKNLKVLQKLMMNDNDISSSTSRTMESESLRTLEFRGNHLDVLWREGDNRYLQLFKNLLKLEELDISKNSLSFLPSGVFDGMPPNLKNLSLAKNGLKSFSWKKLQCLKNLETLDLSHNQLTTVPERLSNCSRSLKNLILKNNQIRSLTKYFLQDAFQLRYLDLSSNKIQMIQKTSFPENVLNNLKMLLLHHNRFLCTCDAVWFVWWVNHTEVTIPYLATDVTCVGPGAHKGQSVISLDLYTCELDLTNLILFSLSISVSLFLMVMMTASHLYFWDVWYIYHFCKAKIKGYQRLISPDCCYDAFIVYDTKDPAVTEWVLAELVAKLEDPREKHFNLCLEERDWLPGQPVLENLSQSIQLSKKTVFVMTDKYAKTENFKIAFYLSHQRLMDEKVDVIILIFLEKPFQKSKFLQLRKRLCGSSVLEWPTNPQAHPYFWQCLKNALATDNHVAYSQVFKETV
  
Inhibitor
Name:
BDBM450162
Synonyms:
US10703755, Example 358
Type:
Small organic molecule
Emp. Form.:
C25H22F2N6O
Mol. Mass.:
460.4786
SMILES:
Cc1nc(O)nc2n(Cc3ccc(C4=CN5CCC4CC5)c(F)c3)c(nc12)-c1cncc(F)c1 |t:13,(-4.73,4.79,;-4.73,3.25,;-6.06,2.48,;-6.06,.94,;-7.39,.17,;-4.73,.17,;-3.39,.94,;-1.93,.47,;-1.53,-1.02,;-.04,-1.42,;1.05,-.33,;2.53,-.73,;2.93,-2.22,;4.42,-2.62,;4.82,-4.1,;6.31,-4.5,;7.39,-3.41,;7,-1.92,;5.51,-1.53,;5.51,-3.07,;6.38,-3.06,;1.84,-3.31,;2.24,-4.79,;.36,-2.91,;-1.02,1.71,;-1.93,2.96,;-3.39,2.48,;.52,1.71,;1.29,.38,;2.83,.38,;3.6,1.71,;2.83,3.05,;3.6,4.38,;1.29,3.05,)|
Structure:
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