Ki Summary

Reaction Details

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Target

Toll-like receptor 8

Ligand

BDBM50560350

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_2071954 (CHEMBL4727488)

IC50

5.0±n/a nM

Citation

Alper, PB; Deane, J; Betschart, C; Buffet, D; Collignon Zipfel, G; Gordon, P; Hampton, J; Hawtin, S; Ibanez, M; Jiang, T; Junt, T; Knoepfel, T; Liu, B; Maginnis, J; McKeever, U; Michellys, PY; Mutnick, D; Nayak, B; Niwa, S; Richmond, W; Rush, JS; Syka, P; Zhang, Y; Zhu, X Discovery of potent, orally bioavailable in vivo efficacious antagonists of the TLR7/8 pathway. Bioorg Med Chem Lett30:0 (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

BDBM50560350

n/a

Name

BDBM50560350

Synonyms:

CHEMBL4783510

Type

Small organic molecule

Emp. Form.

C19H23FN6O

Mol. Mass.

370.4239

SMILES

Cn1nc(-c2ccc(OC[C@H]3CC[C@H](N)CC3)c(F)c2)c2cnc(N)nc12 |r,wU:10.9,wD:13.13,(12.65,-25.23,;12.18,-26.7,;13.1,-27.94,;12.2,-29.19,;12.68,-30.66,;11.65,-31.8,;12.14,-33.26,;13.65,-33.57,;14.13,-35.03,;15.64,-35.34,;16.13,-36.8,;17.64,-37.1,;18.12,-38.57,;17.09,-39.72,;17.57,-41.18,;15.58,-39.4,;15.1,-37.94,;14.67,-32.41,;16.18,-32.72,;14.18,-30.95,;10.73,-28.73,;9.39,-29.51,;8.05,-28.73,;8.05,-27.19,;6.72,-26.42,;9.38,-26.42,;10.72,-27.18,)|

Structure