Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetVitamin D3 receptor
LigandBDBM50446371
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1287003 (CHEMBL3111314)
IC50 2200±n/a nM
Citation Sidhu, PSNassif, NMcCallum, MMTeske, KFeleke, BYuan, NYNandhikonda, PCook, JMSingh, RKBikle, DDArnold, LA Development of novel Vitamin D Receptor-Coactivator Inhibitors. ACS Med Chem Lett5:199-204 (2014) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Vitamin D3 receptor
Name:Vitamin D3 receptor
Synonyms:1,25-dihydroxyvitamin D3 receptor | NR1I1 | Nuclear receptor subfamily 1 group I member 1 | Retinoic acid receptor RXR-alpha/Vitamin D3 receptor | VDR | VDR_HUMAN
Type:Protein
Mol. Mass.:48288.72
Organism:Homo sapiens (Human)
Description:P11473
Residue:427
Sequence:
MEAMAASTSLPDPGDFDRNVPRICGVCGDRATGFHFNAMTCEGCKGFFRRSMKRKALFTC
PFNGDCRITKDNRRHCQACRLKRCVDIGMMKEFILTDEEVQRKREMILKRKEEEALKDSL
RPKLSEEQQRIIAILLDAHHKTYDPTYSDFCQFRPPVRVNDGGGSHPSRPNSRHTPSFSG
DSSSSCSDHCITSSDMMDSSSFSNLDLSEEDSDDPSVTLELSQLSMLPHLADLVSYSIQK
VIGFAKMIPGFRDLTSEDQIVLLKSSAIEVIMLRSNESFTMDDMSWTCGNQDYKYRVSDV
TKAGHSLELIEPLIKFQVGLKKLNLHEEEHVLLMAICIVSPDRPGVQDAALIEAIQDRLS
NTLQTYIRCRHPPPGSHLLYAKMIQKLADLRSLNEEHSKQYRCLSFQPECSMKLTPLVLE
VFGNEIS
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50446371
n/a
NameBDBM50446371
Synonyms:CHEMBL3109597
TypeSmall organic molecule
Emp. Form.C25H23F3N2O3
Mol. Mass.456.4569
SMILESCOc1ccc(NC(c2c(C)[nH]c3ccccc23)c2ccc(OC(F)(F)F)cc2)cc1OC
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: