Target
Oxysterols receptor LXR-beta [154-461]
Ligand
BDBM35087
Substrate
BDBM19993
Meas. Tech.
LXRbeta Binding Assay (IC50) and LAFbeta Functional Assay (EC50)
pH
7.4±n/a
Temperature
277.15±n/a K
IC50
53±n/a nM
EC50
895±n/a nM
Comments
Efficacy=61%.
Citation
 Bernotas, RCKaufman, DHSinghaus, RRUllrich, JUnwalla, RQuinet, ENambi, PWilhelmsson, AGoos-Nilsson, AWrobel, J 4-(3-aryloxyaryl)quinoline alcohols are liver X receptor agonists. Bioorg Med Chem 17:8086-92 (2009) [PubMed]  Article 
Target
Name:
Oxysterols receptor LXR-beta [154-461]
Synonyms:
LXRB | Liver X Receptor beta (LXR-beta) | NER | NR1H2 | NR1H2_HUMAN | Nuclear orphan receptor LXR-beta | Nuclear receptor NER | Nuclear receptor subfamily 1 group H member 2 | Oxysterols receptor LXR-beta | UNR | Ubiquitously-expressed nuclear receptor
Type:
Receptor
Mol. Mass.:
34695.52
Organism:
Homo sapiens (Human)
Description:
LXR beta ligand binding domain (amino acid residues 154-461) with an N-terminal biotinylation tag expressed in E.coli, was used for the binding assays.
Residue:
308
Sequence:
MREQCVLSEEQIRKKKIRKQQQQQESQSQSQSPVGPQGSSSSASGPGASPGGSEAGSQGSGEGEGVQLTAAQELMIQQLVAAQLQCNKRSFSDQPKVTPWPLGADPQSRDARQQRFAHFTELAIISVQEIVDFAKQVPGFLQLGREDQIALLKASTIEIMLLETARRYNHETECITFLKDFTYSKDDFHRAGLQVEFINPIFEFSRAMRRLGLDDAEYALLIAINIFSADRPNVQEPGRVEALQQPYVEALLSYTRIKRPQDQLRFPRMLMKLVSLRTLSSVHSEQVFALRLQDKKLPPLLSEIWDVH
  
Inhibitor
Name:
BDBM35087
Synonyms:
BMC171663 Compound 4a | Benzylquinoline, 8a
Type:
Small organic molecule
Emp. Form.:
C31H22F3NO3
Mol. Mass.:
513.5065
SMILES:
COC(=O)c1cccc(Oc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)c1
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
BDBM19993
Synonyms:
CHEMBL62136 | N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-N-(2,2,2-trifluoroethyl)benzenesulfonamide | T 0901317 | T0901317 | TO-901317 | US10543183, Compound TO901317 | US10669296, Compound TO901317 | US10945978, Compound 1 | [3H]T0901317
Type:
Small organic molecule
Emp. Form.:
C17H12F9NO3S
Mol. Mass.:
481.333
SMILES:
OC(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
Structure:
Search PDB for entries with ligand similarity: