Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetAnti-estrogen binding site (AEBS)
LigandBDBM50430558
Substrate/Competitorn/a
Meas. Tech.ChEMBL_946767
IC50 8000±n/a nM
Citation König, MMüller, CBracher, F Stereoselective synthesis of a new class of potent and selective inhibitors of human¿8,7-sterol isomerase. Bioorg Med Chem21:1925-43 (2013) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Anti-estrogen binding site (AEBS)
Name:3-beta-hydroxysteroid-Delta(8),Delta(7)-isomerase/Delta(24)-sterol reductase
Synonyms:3-beta-hydroxysteroid-delta(8),delta(7)-isomerase | Cholestenol Delta-isomerase | D8-D7 sterol isomerase | Delta(8)-Delta(7) sterol isomerase | Emopamil-binding protein
Type:PROTEIN
Mol. Mass.:26358.51
Organism:Homo sapiens (Human)
Description:ChEMBL_873432
Residue:230
Sequence:
MTTNAGPLHPYWPQHLRLDNFVPNDRPTWHILAGLFSVTGVLVVTTWLLSGRAAVVPLGT
WRRLSLCWFAVCGFIHLVIEGWFVLYYEDLLGDQAFLSQLWKEYAKGDSRYILGDNFTVC
METITACLWGPLSLWVVIAFLRQHPLRFILQLVVSVGQIYGDVLYFLTEHRDGFQHGELG
HPLYFWFYFVFMNALWLVLPGVLVLDAVKHLTHAQSTLDAKATKAKSKKN
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50430558
NameBDBM50430558
Synonyms:CHEMBL2336925
TypeSmall organic molecule
Emp. Form.C26H43NO
Mol. Mass.385.6257
SMILESCC(C)CCC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H](O)[C@H](CC[C@]12C)NCc1ccccc1 |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
n/a