Target
Alpha-1B adrenergic receptor
Ligand
BDBM81444
Substrate
n/a
Ki
2.5±n/a nM
Comments
PDSP_1955
Citation
 Kinsella, GKRozas, IWatson, GW Computational study of antagonist/alpha1A adrenoceptor complexes--observations of conformational variations on the formation of ligand/receptor complexes. J Med Chem 49:501-10 (2006) [PubMed]  Article 
Target
Name:
Alpha-1B adrenergic receptor
Synonyms:
ADRA1B | Adra1b protein | adrenergic Alpha1B
Type:
Enzyme Catalytic Domain
Mol. Mass.:
50983.17
Organism:
Mus musculus
Description:
Q05D47
Residue:
462
Sequence:
MNPDLDTGHNTSAPAHWGELKDANFTGPNQTSSNSTLPQLDVTRAISVGLVLGAFILFAIVGNILVILSVACNRHLRTPTNYFIVNLAIADLLLSFTVLPFSATLEVLGYWVLGRIFCDIWAAVDVLCCTASILSLCAISIDRYIGVRYSLQYPTLVTRRKAILALLSVWVLSTVISIGPLLGWKEPAPNDDKECGVTEEPFYALFSSLGSFYIPLAVILVMYCRVYIVAKRTTKNLEAGVMKEMSNSKELTLRIHSKNFHEDTLSSTKAKGHNPRSSIAVKLFKFSREKKAAKTLGIVVGMFILCWLPFFIALPLGSLFSTLKPPDAVFKVVFWLGYFNSCLNPIIYPCSSKEFKRAFMRILGCQCRGGRRRRRRRRLGGCAYTYRPWTRGGSLERSQSPKDSLDDSGSCMSGSQRTLPSASPSPGYLGLGTQPPVELCASPEWKPGALLSLPEPPGRRGR
  
Inhibitor
Name:
BDBM81444
Synonyms:
CAS_185453 | NSC_185453 | WB 4101 | WB-4101
Type:
Small organic molecule
Emp. Form.:
C25H27NO5
Mol. Mass.:
421.4856
SMILES:
COc1cccc(OC)c1OCCNCC1Oc2ccccc2OC1c1ccccc1
Structure:
Search PDB for entries with ligand similarity: