Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetToll-like receptor 7
LigandBDBM427741
Substrate/Competitorn/a
Meas. Tech.TLR7/8/9 Inhibition Reporter Assays
IC50 0.160±n/a nM
Citation Dyckman, AJDodd, DSMussari, CPSherwood, TCWhiteley, BKGilmore, JLKumar, SRPasunoori, LSrinivas, PVDuraisamy, SKHegde, SAnumula, RK 4-azaindole compounds US Patent US11053244 Publication Date 7/6/2021
More Info.:Get all data from this article,  Assay Method
 
Toll-like receptor 7
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:
MVFPMWTLKRQILILFNIILISKLLGARWFPKTLPCDVTLDVPKNHVIVDCTDKHLTEIP
GGIPTNTTNLTLTINHIPDISPASFHRLDHLVEIDFRCNCVPIPLGSKNNMCIKRLQIKP
RSFSGLTYLKSLYLDGNQLLEIPQGLPPSLQLLSLEANNIFSIRKENLTELANIEILYLG
QNCYYRNPCYVSYSIEKDAFLNLTKLKVLSLKDNNVTAVPTVLPSTLTELYLYNNMIAKI
QEDDFNNLNQLQILDLSGNCPRCYNAPFPCAPCKNNSPLQIPVNAFDALTELKVLRLHSN
SLQHVPPRWFKNINKLQELDLSQNFLAKEIGDAKFLHFLPSLIQLDLSFNFELQVYRASM
NLSQAFSSLKSLKILRIRGYVFKELKSFNLSPLHNLQNLEVLDLGTNFIKIANLSMFKQF
KRLKVIDLSVNKISPSGDSSEVGFCSNARTSVESYEPQVLEQLHYFRYDKYARSCRFKNK
EASFMSVNESCYKYGQTLDLSKNSIFFVKSSDFQHLSFLKCLNLSGNLISQTLNGSEFQP
LAELRYLDFSNNRLDLLHSTAFEELHKLEVLDISSNSHYFQSEGITHMLNFTKNLKVLQK
LMMNDNDISSSTSRTMESESLRTLEFRGNHLDVLWREGDNRYLQLFKNLLKLEELDISKN
SLSFLPSGVFDGMPPNLKNLSLAKNGLKSFSWKKLQCLKNLETLDLSHNQLTTVPERLSN
CSRSLKNLILKNNQIRSLTKYFLQDAFQLRYLDLSSNKIQMIQKTSFPENVLNNLKMLLL
HHNRFLCTCDAVWFVWWVNHTEVTIPYLATDVTCVGPGAHKGQSVISLDLYTCELDLTNL
ILFSLSISVSLFLMVMMTASHLYFWDVWYIYHFCKAKIKGYQRLISPDCCYDAFIVYDTK
DPAVTEWVLAELVAKLEDPREKHFNLCLEERDWLPGQPVLENLSQSIQLSKKTVFVMTDK
YAKTENFKIAFYLSHQRLMDEKVDVIILIFLEKPFQKSKFLQLRKRLCGSSVLEWPTNPQ
AHPYFWQCLKNALATDNHVAYSQVFKETV
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM427741
n/a
NameBDBM427741
Synonyms:US10544143, Example 174 | US10730877, Example 199 | US11053244, Example 199
TypeSmall organic molecule
Emp. Form.C27H34N6O
Mol. Mass.458.5985
SMILESCOc1cc(cn2ncnc12)-c1[nH]c2ccc(nc2c1C(C)C)C1CCC(CC1)N1CCCC1 |(9.39,.97,;7.85,.97,;7.08,-.36,;5.54,-.36,;4.77,-1.69,;5.54,-3.03,;7.08,-3.03,;8.11,-4.17,;9.51,-3.55,;9.35,-2.01,;7.85,-1.69,;3.23,-1.69,;2.32,-2.94,;.86,-2.46,;-.48,-3.23,;-1.81,-2.46,;-1.81,-.92,;-.48,-.15,;.86,-.92,;2.32,-.45,;2.72,1.04,;1.63,2.13,;4.21,1.44,;-3.14,-.15,;-4.48,-.92,;-5.81,-.15,;-5.81,1.39,;-4.48,2.16,;-3.14,1.39,;-7.14,2.16,;-7.14,3.7,;-8.61,4.17,;-9.51,2.93,;-8.61,1.68,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: