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TargetVitamin D3 receptor
LigandBDBM50544019
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1991216 (CHEMBL4624951)
IC50 2653±n/a nM
Citation Masuda, AGohda, KIguchi, YFujimori, KYamashita, YOda, KUne, MTeno, N N Bioorg Med Chem28:0 (2020) [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
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  Blast E-value cutoff:
BDBM50544019
n/a
NameBDBM50544019
Synonyms:CHEMBL4642737
TypeSmall organic molecule
Emp. Form.C31H27Cl2N3O4
Mol. Mass.576.47
SMILESCC(C)c1onc(c1COc1ccc(cc1)-c1nc2ccc(cc2n1CC1CC1)C(O)=O)-c1c(Cl)cccc1Cl |(8.79,-13.89,;9.42,-12.48,;10.95,-12.32,;8.52,-11.24,;6.97,-11.24,;6.5,-9.77,;7.74,-8.86,;8.99,-9.77,;10.46,-9.29,;11.61,-10.32,;13.07,-9.85,;14.22,-10.88,;15.67,-10.41,;16,-8.9,;14.85,-7.86,;13.38,-8.35,;17.47,-8.42,;18.71,-9.32,;19.95,-8.41,;21.45,-8.73,;22.48,-7.58,;22,-6.12,;20.5,-5.81,;19.48,-6.95,;17.94,-6.95,;17.03,-5.71,;17.65,-4.3,;18.89,-3.41,;17.48,-2.79,;23.02,-4.96,;24.53,-5.28,;22.54,-3.5,;7.73,-7.32,;9.07,-6.54,;10.41,-7.32,;9.07,-4.99,;7.73,-4.23,;6.4,-5,;6.4,-6.54,;5.07,-7.32,)|
Structure
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