Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetToll-like receptor 8
LigandBDBM50514795
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1858564 (CHEMBL4359293)
IC50 10120±n/a nM
Citation Jiang, STanji, HYin, KZhang, SSakaniwa, KHuang, JYang, YLi, JOhto, UShimizu, TYin, H Rationally Designed Small-Molecule Inhibitors Targeting an Unconventional Pocket on the TLR8 Protein-Protein Interface. J Med Chem63:4117-4132 (2020) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Toll-like receptor 8
Name:Toll-like receptor 8
Synonyms:CD_antigen: CD288 | TLR8 | TLR8_HUMAN | TRL8
Type:Enzyme
Mol. Mass.:119828.77
Organism:Homo sapiens (Human)
Description:Q9NR97
Residue:1041
Sequence:
MENMFLQSSMLTCIFLLISGSCELCAEENFSRSYPCDEKKQNDSVIAECSNRRLQEVPQT
VGKYVTELDLSDNFITHITNESFQGLQNLTKINLNHNPNVQHQNGNPGIQSNGLNITDGA
FLNLKNLRELLLEDNQLPQIPSGLPESLTELSLIQNNIYNITKEGISRLINLKNLYLAWN
CYFNKVCEKTNIEDGVFETLTNLELLSLSFNSLSHVPPKLPSSLRKLFLSNTQIKYISEE
DFKGLINLTLLDLSGNCPRCFNAPFPCVPCDGGASINIDRFAFQNLTQLRYLNLSSTSLR
KINAAWFKNMPHLKVLDLEFNYLVGEIASGAFLTMLPRLEILDLSFNYIKGSYPQHINIS
RNFSKLLSLRALHLRGYVFQELREDDFQPLMQLPNLSTINLGINFIKQIDFKLFQNFSNL
EIIYLSENRISPLVKDTRQSYANSSSFQRHIRKRRSTDFEFDPHSNFYHFTRPLIKPQCA
AYGKALDLSLNSIFFIGPNQFENLPDIACLNLSANSNAQVLSGTEFSAIPHVKYLDLTNN
RLDFDNASALTELSDLEVLDLSYNSHYFRIAGVTHHLEFIQNFTNLKVLNLSHNNIYTLT
DKYNLESKSLVELVFSGNRLDILWNDDDNRYISIFKGLKNLTRLDLSLNRLKHIPNEAFL
NLPASLTELHINDNMLKFFNWTLLQQFPRLELLDLRGNKLLFLTDSLSDFTSSLRTLLLS
HNRISHLPSGFLSEVSSLKHLDLSSNLLKTINKSALETKTTTKLSMLELHGNPFECTCDI
GDFRRWMDEHLNVKIPRLVDVICASPGDQRGKSIVSLELTTCVSDVTAVILFFFTFFITT
MVMLAALAHHLFYWDVWFIYNVCLAKVKGYRSLSTSQTFYDAYISYDTKDASVTDWVINE
LRYHLEESRDKNVLLCLEERDWDPGLAIIDNLMQSINQSKKTVFVLTKKYAKSWNFKTAF
YLALQRLMDENMDVIIFILLEPVLQHSQYLRLRQRICKSSILQWPDNPKAEGLFWQTLRN
VVLTENDSRYNNMYVDSIKQY
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50514795
n/a
NameBDBM50514795
Synonyms:CHEMBL4475464
TypeSmall organic molecule
Emp. Form.C14H17Cl2N3OS
Mol. Mass.346.275
SMILESCC(C)Sc1nnc(CCCO)n1-c1ccc(Cl)cc1Cl |(27.07,-36.52,;27.97,-35.27,;29.51,-35.44,;27.35,-33.87,;28.25,-32.62,;29.79,-32.62,;30.27,-31.16,;29.02,-30.25,;29.02,-28.71,;30.36,-27.94,;31.69,-28.71,;33.02,-27.94,;27.78,-31.16,;26.31,-30.68,;25.17,-31.71,;23.7,-31.24,;23.38,-29.73,;21.92,-29.25,;24.53,-28.7,;25.99,-29.17,;27.14,-28.14,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: